Metabolite_name	RefMet_name	old_1	old_11	old_13	old_5	old_7	young_10	young_12	young_7	old_10	old_12	old_2	old_4	old_8	old_9	young_1	young_11	young_2	young_3	young_4	young_5	young_6	young_8	young_9
Factors	-	Sample source:Heart | Sex:F | Age group:old	Sample source:Heart | Sex:F | Age group:old	Sample source:Heart | Sex:F | Age group:old	Sample source:Heart | Sex:F | Age group:old	Sample source:Heart | Sex:F | Age group:old	Sample source:Heart | Sex:F | Age group:young	Sample source:Heart | Sex:F | Age group:young	Sample source:Heart | Sex:F | Age group:young	Sample source:Heart | Sex:M | Age group:old	Sample source:Heart | Sex:M | Age group:old	Sample source:Heart | Sex:M | Age group:old	Sample source:Heart | Sex:M | Age group:old	Sample source:Heart | Sex:M | Age group:old	Sample source:Heart | Sex:M | Age group:old	Sample source:Heart | Sex:M | Age group:young	Sample source:Heart | Sex:M | Age group:young	Sample source:Heart | Sex:M | Age group:young	Sample source:Heart | Sex:M | Age group:young	Sample source:Heart | Sex:M | Age group:young	Sample source:Heart | Sex:M | Age group:young	Sample source:Heart | Sex:M | Age group:young	Sample source:Heart | Sex:M | Age group:young	Sample source:Heart | Sex:M | Age group:young
AcCa(10:0)+H	CAR 10:0	1.5937	0.2698	0.3944	0.2622	0.1513	7.2903	0.3299	8.3975	0.4782	2.6812	0.3945	0.5676	0.2004	0.4183	0.3625	0.6456	1.2536	0.5891	0.7367	4.5235	0.0069	0.1251	0.2317
AcCa(10:1)+H	CAR 10:1	0.0485	0.0548	0.0549	0.0360	0.0254	0.2428	0.0752	0.2135	0.0369	0.1386	0.0636	0.0741	0.0088	0.0718	0.0257	0.1041	0.0691	0.0178	0.0598	0.1391	0.0099	0.0242	0.0649
AcCa(12:0)+H	CAR 12:0	1.0375	0.7211	0.4685	0.4213	0.2361	3.9511	0.3979	3.4073	0.6693	1.4158	0.6165	0.7002	0.2545	0.8052	0.3633	0.9036	0.8009	0.3799	0.7495	2.2112	0.0191	0.1429	0.4474
AcCa(12:1)+H	CAR 12:1	0.2005	0.2003	0.0904	0.1042	0.0368	0.2628	0.1596	0.0297	0.0902	0.1130	0.1739	0.4049	0.0205	0.3039	0.0746	0.1022	0.1133	0.0206	0.1883	0.0903	0.0271	0.0426	0.1376
AcCa(13:0)+H	CAR 13:0	0.1200	0.3295	0.1680	0.0640	0.0329	0.3989	0.1313	0.1131	0.2029	0.0762	0.0636	0.1206	0.0682	0.1820	0.1216	0.2017	0.0678	0.0185	0.1071	0.0743	0.0483	0.0246	0.1303
AcCa(14:0)+H	CAR 14:0	6.1008	3.5416	1.7307	2.6978	0.7186	4.9369	2.6397	2.3956	7.1321	4.1558	2.4691	3.8985	0.8128	4.8400	3.1751	3.9244	3.2652	1.0713	2.6254	4.4559	0.5456	0.6188	2.8183
AcCa(14:2)+H	CAR 14:2	0.1699	0.1894	0.0733	0.1104	0.0522	0.0388	0.0807	0.0073	0.1373	0.0935	0.0815	0.3564	0.0093	0.3257	0.0204	0.0752	0.0441	0.0298	0.0413	0.0879	0.0015	0.0227	0.1181
AcCa(16:0)+H	CAR 16:0	40.4674	7.4189	9.1134	7.6064	2.0167	9.9728	6.0878	0.8443	21.2372	19.6236	7.9042	9.5465	3.7162	16.5471	10.0047	7.4000	9.7198	6.6652	3.7494	16.8489	2.4111	2.2094	8.8106
AcCa(16:1)+H	CAR 16:1	17.1574	4.8855	2.0452	3.9852	0.6274	4.5179	3.5111	0.1535	8.5253	5.7829	5.3207	7.5956	0.6635	8.3706	2.8888	3.5532	5.1552	2.1284	1.7811	7.0575	0.9129	0.8631	3.9335
AcCa(17:0)+H	CAR 17:0	0.8833	0.8427	0.9837	0.2330	0.0728	0.6818	0.3766	0.0512	1.5416	0.4092	0.5733	0.5340	0.2976	0.3351	0.3639	0.3917	0.6332	0.1962	0.2995	0.7252	0.0814	0.1195	1.1998
AcCa(18:0)+H	CAR 18:0	13.6584	4.8964	8.0386	3.1020	1.1788	3.4847	1.6931	0.1348	5.0934	2.5170	2.6168	2.7117	2.4160	6.8893	8.7080	8.1413	2.3031	3.7964	3.4975	3.9392	2.5393	1.7382	5.7920
AcCa(18:1)+H	CAR 18:1	88.6942	11.0466	10.6175	9.5413	1.9902	11.4137	7.9136	0.4713	22.1234	9.4746	9.0007	15.5250	3.5396	26.4041	8.9833	6.3175	13.6949	10.2458	3.7874	22.5823	3.4997	2.2555	12.3824
AcCa(18:2)+H	CAR 18:2	8.9654	2.8106	3.4708	1.5672	1.0763	2.1301	2.0184	0.1732	4.8520	3.2813	1.7768	5.9068	0.6075	3.7376	0.7196	1.0347	2.6326	1.4843	0.9178	5.3321	0.8633	0.3733	2.5651
AcCa(18:3)+H	CAR 18:3	0.7058	0.2267	0.1219	0.1005	0.0662	0.2459	0.2051	0.0137	0.4943	0.3023	0.1894	0.3929	0.0612	0.2492	0.0222	0.0342	0.2202	0.1055	0.0375	0.2705	0.0340	0.0238	0.2147
AcCa(19:0)+H	CAR 19:0	0.5014	0.8669	1.0089	0.2013	0.0823	0.5396	0.2166	0.0203	0.9265	0.2545	0.4505	0.3584	0.2928	0.1224	0.8883	0.9708	0.3722	0.2144	0.5252	0.4101	0.1618	0.2015	1.1000
AcCa(19:1)+H	CAR 19:1	1.2323	1.4043	1.2793	0.2244	0.0471	0.8103	0.3710	0.0320	1.6721	0.3891	0.6714	0.7259	0.2343	0.1847	0.3018	0.3139	0.7650	0.1836	0.3116	0.8159	0.0725	0.1222	1.7581
AcCa(20:0)+H	CAR 20:0	0.1306	0.0846	0.7202	0.1790	0.1548	0.0745	0.0246	0.0031	0.0747	0.0771	0.0199	0.0328	0.0791	0.1758	1.7386	1.3305	0.0215	0.1224	0.4676	0.0401	0.0452	0.1910	0.1766
AcCa(20:1)+H	CAR 20:1	9.1951	1.1689	6.4718	2.6183	0.4709	2.1186	0.6386	0.0378	2.6544	1.4268	0.4438	0.8300	1.0950	3.4869	9.5972	6.1580	1.2954	2.4639	1.9920	2.2233	1.5256	1.0755	2.4013
AcCa(20:2)+H	CAR 20:2	2.2759	0.2932	2.4170	0.7023	0.2807	0.7732	0.3325	0.0263	1.2685	0.9315	0.1707	0.5722	0.2903	1.0952	0.8329	1.1004	0.5791	0.7979	0.4334	1.2184	0.1713	0.3194	0.6885
AcCa(20:4)+H	CAR 20:4	0.2520	0.4202	0.0848	0.1662	0.0760	0.0471	0.1160	0.0073	0.1170	0.0770	0.1559	0.3962	0.0198	0.2416	0.0284	0.0575	0.0411	0.1026	0.1038	0.0819	1.4324	0.0121	0.0828
AcCa(21:0)+H	CAR 21:0	0.0121	0.0215	0.1853	0.0191	0.0219	0.0287	0.0072		0.0310	0.0154	0.0076	0.0090	0.0251	0.0021	0.3102	0.3154	0.0072	0.0174	0.1283	0.0094	0.0068	0.0397	0.0816
AcCa(21:1)+H	CAR 21:1	0.2778	0.2672	1.1980	0.1346	0.0202	0.3407	0.0904	0.0036	0.4866	0.1375	0.0872	0.1114	0.1550	0.0405	0.7856	0.7234	0.1932	0.1007	0.3047	0.2129	0.0623	0.1308	0.6814
AcCa(22:1)+H	CAR 22:1	0.1277	0.0431	0.8221	0.1919	0.1596	0.0627	0.0129		0.0514	0.0552	0.0087	0.0152	0.0577	0.1006	2.6840	1.3435	0.0196	0.1036	0.3960	0.0362	0.0625	0.1381	0.1035
AcCa(22:2)+H	CAR 22:2	0.1159	0.0212	1.4498	0.1352	0.1349	0.0622	0.0154	0.0008	0.0782	0.0882	0.0015	0.0252	0.0540	0.0900	0.6492	0.7495	0.0210	0.1241	0.2128	0.0605	0.0822	0.1183	0.1136
AcCa(22:4)+H	CAR 22:4	0.2501	0.0506	0.0447	0.0170	0.0118	0.0774	0.0270	0.0017	0.0811	0.0162	0.0226	0.0431	0.0124	0.1031	0.0085	0.0288	0.0271	0.1875	0.0148	0.0890	0.0308	0.0142	0.0405
AcCa(6:0)+H	CAR 6:0	0.6699	0.2601	2.1527	2.6977	0.5323	12.4062	2.0593	3.9368	2.3238	2.0244	0.3514	1.4706	0.1743	1.2150	3.4455	8.1789	3.9401	0.5706	3.5199	1.7810	0.0293	0.4592	2.5313
AcCa(8:0)+H	CAR 8:0	2.8128	0.1658	0.9224	0.4668	0.1950	20.7537	0.3591	25.2790	0.7076	9.2845	0.2309	0.4154	0.3803	0.3709	0.6658	1.6522	4.0295	1.2039	1.6713	9.6847	0.0160	0.1643	0.3961
AcCa(9:0)+H	CAR 9:0	0.0467	0.0313	0.1212	0.0452	0.0230	0.2830	0.0552	0.1221	0.1755	0.0492	0.0279	0.0255	0.0061	0.0778	0.0555	0.1971	0.0719	0.0276	0.1029	0.0472	0.0162	0.0177	0.0488
Cer(d18:1_12:0)+HCOO	Cer 18:1;O2/12:0	0.2345	0.0899	0.0561	1.5429	0.3980	0.9370	0.4713	0.2570	0.2863	0.2152	0.1971	0.7600	0.0860	1.1829	0.1933	0.5870	0.5191	0.2715	0.1530	0.5468	1.1664	0.1199	0.1797
Cer(d18:1_16:0)+HCOO	Cer 18:1;O2/16:0	1.1185	0.7899	0.9813	0.6232	0.8634	1.4165	1.1071	0.9533	0.8757	1.1043	0.9800	1.5571	1.0683	2.0621	0.9017	0.9655	0.9330	0.4838	0.8616	1.5085	19.6284	0.6025	0.8231
Cer(d18:1_18:0)+HCOO	Cer 18:1;O2/18:0	1.0595	1.1390	3.5544	0.3798	0.5284	0.4557	1.1822	0.6592	1.0041	1.2497	0.6548	0.9812	1.5616	0.8166	1.1882	0.7383	0.4364	0.2240	0.9539	0.4509	6.9767	0.4306	2.3142
Cer(d18:1_22:0)+HCOO	Cer 18:1;O2/22:0	0.1081	0.5478	1.3707	0.5310	0.1465	0.1118	0.1744	0.3334	0.1955	0.2282	0.1257	0.3067	0.8512	0.5405	0.3863	0.2606	0.0885	0.0843	0.2277	0.1268	0.5423	0.1263	0.8746
Cer(d18:1_23:0)+HCOO	Cer 18:1;O2/23:0	0.0802	0.2851	0.4650	0.4633	0.0907	0.0892	0.0803	0.1737	0.1055	0.1198	0.0783	0.1343	0.5628	0.5281	0.1330	0.1312	0.0697	0.0864	0.1601	0.1675	0.2664	0.0629	0.3633
Cer(d18:1_24:0)+HCOO	Cer 18:1;O2/24:0	0.1233	0.7256	1.1421	0.8807	0.1565	0.1692	0.1589	0.3773	0.2291	0.2646	0.1696	0.3277	1.1094	0.7750	0.4962	0.3480	0.1187	0.0798	0.3295	0.1653	0.2734	0.1219	0.8207
Cer(d18:1_24:1)+HCOO	Cer 18:1;O2/24:1	0.7883	2.3521	3.2095	1.0012	0.7351	0.4957	0.7584	1.1332	0.8611	1.9554	0.6843	0.9770	4.7547	1.1689	1.8339	0.9050	0.5133	0.5003	0.6196	0.7723	3.0022	0.3308	3.5121
Cer(d18:2_18:0)+HCOO	Cer 18:2;O2/18:0	1.4972	0.5131	0.6706	0.2985	0.7263	0.5313	1.2509	0.4977	1.5177	1.3340	0.5962	1.5083	0.8315	1.6309	0.5117	0.3071	0.7728	0.3276	0.4780	0.6749	19.4798	0.3134	0.7575
Cer(d18:2_22:0)+HCOO	Cer 18:2;O2/22:0	0.2199	0.6578	0.8518	0.2240	0.3130	0.1200	0.3167	0.2485	0.2663	0.4464	0.1681	0.4471	1.3460	0.3083	0.6031	0.1989	0.2338	0.2075	0.1754	0.2333	0.9220	0.1006	0.9217
Cer(d18:2_23:0)+HCOO	Cer 18:2;O2/23:0	0.0620	0.1023	0.0802	0.0190	0.0388	0.0165	0.0432	0.0515	0.0503	0.0601	0.0201	0.0520	0.2404	0.0587	0.0628	0.0295	0.0216	0.0245	0.0304	0.0336	0.2176	0.0138	0.1577
Cer(d18:2_24:1)+HCOO	Cer 18:2;O2/24:1	0.9118	1.1533	2.0365	0.3099	0.6283	0.3528	0.7689	0.5459	0.8357	1.4675	0.4544	0.7936	3.3152	0.8397	1.3131	0.4558	0.5149	0.5739	0.3075	0.7836	1.4724	0.2653	2.0143
DG(16:0_16:0)+NH4	DG 16:0_16:0	43.3146	14.1407	5.6706	76.4617	26.7020	22.6468	31.8862	46.9299	23.8970	23.4197	24.5679	32.4492	3.6542	231.9840	13.6093	22.8209	15.7108	22.7551	15.0572	32.4686	71.9504	25.3414	6.9573
DG(16:0_18:1)+NH4	DG 16:0_18:1	51.0354	22.7230	18.5855	31.9939	17.8344	20.8611	26.7896	35.8733	20.6747	36.0981	46.4418	30.8984	21.1830	113.9920	20.2427	15.9323	18.3934	61.7382	18.6217	31.0644	134.8278	16.8507	19.2407
DG(16:0_20:4)+NH4	DG 16:0_20:4	4.0074	2.7856	2.2194	2.3214	2.9678	6.8163	3.8814	2.3065	2.2542	4.0207	5.0198	7.5411	2.1100	2.3796	1.2527	4.4035	3.5967	3.9038	1.6679	5.0641	11.1370	1.1678	3.1363
DG(16:1_18:1)+NH4	DG 16:1_18:1	26.8299	5.1988	16.5630	21.6961	21.7084	8.4475	11.0548	17.6797	16.8647	45.2546	15.3503	21.7272	5.7344	44.6487	2.5497	10.3508	7.9889	32.1326	4.7458	13.9989	60.9127	13.2321	10.6984
DG(18:0_16:0)+NH4	DG 16:0_18:0	79.4154	28.9547	8.7512	153.0349	63.5710	50.0185	61.0726	84.5263	53.7723	51.8325	46.6750	72.5262	4.0224	547.5159	23.3871	37.9481	29.3378	44.5987	26.5845	73.6442	110.4163	47.1694	11.3165
DG(18:0_18:0)+NH4	DG 18:0_18:0	51.6553	20.5284	4.7080	118.2885	39.7978	32.5697	40.0227	61.1228	36.6408	29.6361	30.6644	51.0578	3.0607	432.9113	15.3118	24.8059	19.4673	27.5743	18.2395	46.8611	82.1657	27.6967	6.8198
DG(18:0_18:1)+NH4	DG 18:0_18:1	7.0994	5.6840	3.0699	7.4834	3.9137	3.5072	5.0869	6.7356	4.1525	5.1526	7.5372	6.2688	5.2982	30.4719	3.9786	4.9438	3.7096	4.3686	5.1265	5.7360	18.8385	3.3142	6.1595
DG(18:0_18:2)+NH4	DG 18:0_18:2	65.0699	28.2666	26.8016	35.0717	23.0498	26.9288	30.5189	35.5490	21.1587	35.7201	51.5366	59.5890	25.9473	97.0986	25.1587	25.7057	26.0613	42.6469	21.9355	29.5056	146.0235	13.9007	33.3000
DG(18:0_20:3)+NH4	DG 18:0_20:3	1.0413	1.1158	0.9541	2.7275	0.4300	2.7319	2.6474	1.9381	1.2188	1.4322	1.6199	2.8326	2.0588	5.2114	1.3555	1.3751	1.6712	0.5127	2.0913	0.7945	2.7816	1.4891	4.0638
DG(18:0_22:5)+NH4	DG 18:0_22:5	0.1189	1.1259	1.2591	0.1034	0.0593	0.5408	1.0983	0.9486	0.9436	0.3483	0.5474	1.5099	2.0804	0.3159	0.7714	1.6777	0.8082	0.1177	1.3015	0.2380	1.1618	0.3523	3.4021
DG(18:1_14:0)+NH4	DG 14:0_18:1	39.2406	6.8704	5.7885	22.5452	15.8017	16.0782	16.3034	28.6638	14.7102	22.2420	35.1597	24.6296	3.6070	60.9711	7.3740	8.1494	10.3928	75.1894	4.9592	19.5873	91.4454	13.4347	5.0761
DG(18:1_18:2)+NH4	DG 18:1_18:2	37.9831	12.0198	19.8060	12.7058	22.9655	18.8288	19.4352	24.1361	15.9820	35.6398	25.2390	53.9512	15.2208	34.0233	9.6944	11.1514	19.6944	31.1918	13.4586	22.1337	101.0598	8.0150	16.7413
DG(18:1_20:4)+NH4	DG 18:1_20:4	7.1307	4.2857	5.0691	1.4328	2.7040	14.6520	7.4267	3.6016	2.9917	3.8501	7.0973	14.7576	4.6781	2.0653	3.4124	5.5049	9.3336	3.8019	4.3513	4.6421	21.0057	1.6516	9.5631
DG(18:2_18:2)+NH4	DG 18:2_18:2	20.6216	21.7526	26.5663	8.7386	28.7364	43.5365	39.3136	36.9274	30.3949	45.6720	59.7163	66.7856	15.0106	45.0225	10.7852	23.1774	34.0454	17.8052	27.7657	25.0993	61.0192	12.5263	62.0950
Hex1Cer(d18:0_20:4)+HCOO	HexCer 18:0;O2/20:4	6.9575	11.0457	2.9411	0.9632	4.2176	3.8691	6.2418	6.4141	4.1781	4.9984	7.4377	8.5640	6.9630	3.0383	5.3894	7.2156	4.8057	6.4946	6.3699	6.7786	4.8786	5.8868	7.3290
Hex1Cer(d18:1_20:4)+HCOO	HexCer 18:1;O2/20:4	9.8185	9.6446	3.9102	2.0371	4.8250	7.1724	6.5727	8.8666	6.3189	4.4530	9.0174	8.5686	7.5975	5.5230	8.0920	5.4345	6.4365	6.0180	7.7007	8.2817	6.4114	7.7228	8.1159
Hex1Cer(d18:1_22:4)+HCOO	HexCer 18:1;O2/22:4	29.6292	3.6304	1.8960	3.0809	14.8494	29.3207	16.6886	12.1856	18.0601	20.3505	20.5191	22.2977	13.8657	4.9238	14.1526	17.3457	17.6247	12.6757	16.6399	12.9191	14.9512	15.5445	4.3230
Hex1Cer(d18:1_24:0)+H	HexCer 18:1;O2/24:0	0.1061	0.6502	0.3672	0.2647	0.1481	0.0875	0.0247	0.0948	0.0102	0.1349	0.1001	0.1756	0.9425	0.0604	0.3742	0.3223	0.1366	0.1557	0.0587	0.0094	0.0070	0.2149	0.6221
Hex1Cer(d18:1_24:1)+H	HexCer 18:1;O2/24:1	0.1030	0.2642	0.4011	0.0154	0.0532	0.0105	0.0474	0.0447	0.0124	0.1693	0.1169	0.1257	0.3582	0.0007	0.3383	0.0826	0.0440	0.0791	0.0771	0.0324	0.0124	0.1463	0.4335
Hex1Cer(d19:0_20:4)+HCOO	HexCer 19:0;O2/20:4	4.3140	1.5347	0.7291	0.7674	1.9702	2.4907	3.5976	2.6673	3.9061	3.8154	3.0572	4.9502	4.9694	1.7252	4.5052	5.7965	1.4745	2.0321	4.2135	2.6883	2.9903	2.2290	1.5765
Hex1Cer(d20:0_22:6)+HCOO	HexCer 20:0;O2/22:6	2.1365	0.3319	0.5698	0.3874	2.1495	2.0016	2.0603	2.4975	1.1443	3.4829	1.5113	3.1975	1.9614	0.2447	0.9975	1.5829	1.5629	0.6615	1.2067	1.3882	0.8505	0.7830	0.9005
Hex1Cer(d41:1)+HCOO	HexCer 41:1;O2	0.0129	0.2318	0.2621	0.0017	0.0037	0.0076	0.0067	0.0124	0.0128	0.0229	0.0171	0.0111	0.1953	0.0005	0.0785	0.0779	0.0023	0.0050	0.0401	0.0032	0.0010	0.0162	0.2320
Hex1Cer(d42:1)+HCOO	HexCer 42:1;O2	0.0146	0.3283	0.7410	0	0.0075	0.0119	0.0126	0.0258	0.0193	0.0316	0.0325	0.0217	0.3376	0.0033	0.1948	0.0992	0	0.0135	0.0452	0.0080	0.0026	0.0360	0.4201
Hex1Cer(t18:0_22:0)+H-H2O	HexCer 18:0;O3/22:0	0.0918	0.8112	0.5086	0.2482	0.0382	0.1119	0.0594	0.0881	0.0932	0.2604	0.1961	0.2754	0.6782	0.3026	0.3781	0.3770	0.2136	0.1074	0.1756	0.2289	0.0330	0.2388	0.7546
Hex1Cer(t18:0_23:0)+H-H2O	HexCer 18:0;O3/23:0	0.0127	0.2078	0.1662	0.0992	0.0827	0.0669	0.0867	0.0368	0.0870	0.1198	0.0930	0.0407	0.3761	0.1105	0.1810	0.0906	0.0881	0.0919	0.0727	0.0470	0.0101	0.0725	0.2165
Hex1Cer(t20:0_20:4)+HCOO	HexCer 20:0;O3/20:4	17.1664	0.7719	0.2584	1.0614	7.2661	2.4460	7.5689	3.0993	2.3630	9.3574	6.7655	12.5271	6.5311	13.6265	12.3273	16.9681	2.4822	10.1853	8.3106	4.1792	10.9635	3.0534	0.4385
Hex1Cer(t20:1_20:4)+HCOO	HexCer 20:1;O3/20:4*	65.1511	1.3345	0.2604	4.6749	27.0247	15.7579	28.5386	16.6911	18.0934	35.0658	23.3382	43.3288	31.5877	39.1990	44.3917	46.9986	11.7404	32.8397	26.7840	26.3262	39.9260	15.3595	1.9361
LPC(14:0)+H	LPC 14:0	7.4557	24.6477	15.4362	3.6743	3.0791	11.6148	6.5163	7.5837	11.1042	5.2524	13.6494	7.9059	9.1605	3.4802	5.7364	5.3327	4.2276	2.0714	9.7865	6.5848	8.3861	5.0376	13.1622
LPC(15:0)+H	LPC 15:0	3.4482	12.8820	4.6453	1.5710	1.6277	4.4779	3.7556	3.1517	4.7069	1.8697	3.9285	3.9214	4.2483	1.7379	1.9362	2.7443	2.2538	0.9997	5.3693	3.4570	6.2219	3.3208	6.9446
LPC(16:0e)+H	LPC O-16:0	1.3685	4.6084	5.5298	0.6322	1.0097	2.1168	1.8473	1.4966	2.0664	1.5159	2.4176	1.6795	2.2267	0.4749	2.0016	2.4615	1.3433	0.5005	1.6858	2.2436	2.5509	1.2941	4.2083
LPC(16:0)+H	LPC 16:0	207.1842	870.2725	673.1096	113.4073	235.7080	435.0453	326.5985	348.3288	421.2850	328.2309	426.8177	398.1182	376.6727	83.3097	322.9424	290.2237	230.8886	93.8078	303.5214	327.2630	486.0554	332.4866	616.1069
LPC(16:1e)+H	LPC O-16:1	7.8148	7.4351	6.4673	3.7379	8.7704	10.7115	12.5536	7.2559	7.7713	11.6714	5.0531	15.1964	8.6559	6.1588	8.8013	15.3414	5.9924	6.5689	13.5135	7.0638	25.8853	6.6821	6.7340
LPC(16:1)+H	LPC 16:1	17.2703	43.3470	37.9735	4.5746	6.8444	33.5989	11.6541	11.2295	14.1413	11.0434	23.2541	16.6026	12.3427	3.9491	19.4387	7.4527	6.9282	4.0258	10.1654	10.7518	13.1541	12.8634	22.4133
LPC(16:2e)+H	LPC O-16:2	1.5408	6.9486	5.5633	0.8675	1.7561	3.2284	2.3513	2.6524	3.4335	2.2942	3.3853	2.7140	2.7897	0.6651	2.5743	2.1769	1.6340	0.6925	2.4812	2.4376	3.9475	2.5853	4.5603
LPC(17:1)+H	LPC 17:1	1.6792	4.2912	2.3272	0.5259	0.6415	2.6443	1.6398	1.1811	1.4798	0.7472	1.4822	1.4523	1.2659	0.5337	1.2776	0.8149	0.9074	0.3509	1.8368	1.3374	2.0274	1.0910	3.1914
LPC(18:0)+H	LPC 18:0	20.4670	46.5584	61.1869	10.3827	21.9684	35.7493	34.7841	37.6824	41.0551	27.4252	40.6910	35.7066	55.8011	8.9213	33.2617	27.3506	22.0907	12.3730	28.7006	36.6654	74.3359	34.2549	68.6035
LPC(18:1e)+H	LPC O-18:1	0.7024	3.7989	3.9716	0.3519	0.6438	1.2063	1.0986	1.1860	0.9654	0.8644	1.3126	1.0323	1.4768	0.2339	1.4018	1.7220	0.6941	0.3480	0.8488	1.2244	1.6812	1.0760	2.4495
LPC(18:1)+H	LPC 18:1	328.8993	930.6227	540.9247	169.8000	300.9240	801.2012	462.2204	419.1392	561.4041	374.3289	535.3032	465.9581	293.3615	111.7222	509.2465	414.3477	320.4125	125.7745	430.7825	318.4723	444.9213	419.8601	623.9499
LPC(18:2e)+H	LPC O-18:2	2.6639	1.3332	1.5998	0.7173	1.8958	2.1305	2.5919	1.9960	2.1797	3.1249	1.8902	3.3679	3.0248	0.9609	3.0108	3.6594	1.0809	0.7785	1.9363	1.6134	5.2767	1.1751	1.2027
LPC(18:2)+H	LPC 18:2	520.0699	1346.0316	1128.8823	390.6645	940.7616	967.3752	932.9395	1036.2925	689.0826	1029.8446	744.1045	1205.2773	510.3292	151.6931	361.4656	699.8125	657.0857	204.5728	639.6973	844.5916	355.3929	449.4437	1072.8534
LPC(18:3e)+H	LPC O-18:3	1.7415	4.9930	3.1985	0.8768	1.5447	4.2026	2.4089	2.2823	2.8413	1.9452	3.0981	2.4495	1.5088	0.5557	2.7818	2.1910	1.6821	0.6486	2.4850	1.5755	2.3844	2.5494	3.1580
LPC(19:0)+H	LPC 19:0	5.4223	8.8504	11.4401	1.2254	5.0711	9.1465	6.2002	8.5498	8.7758	6.7739	9.9054	7.6399	12.9598	1.4467	12.5407	6.4497	8.7963	5.8041	4.9373	7.3308	3.3746	7.2479	10.4669
LPC(20:1)+H	LPC 20:1	1.4437	3.5063	2.7099	0.4857	1.0134	2.6334	1.8205	2.1793	1.4919	1.3648	1.8630	1.8251	3.7474	0.2894	1.4907	1.7889	1.3662	0.5401	1.1542	1.7934	4.2183	1.5379	3.1425
LPC(20:2)+H	LPC 20:2	2.3372	4.9283	6.0825	0.9427	2.3492	3.7751	2.7099	2.8779	2.1939	4.1639	3.1725	3.3713	3.8447	0.5964	2.1842	1.9432	2.0191	0.9604	2.0512	3.0412	1.8824	2.2437	3.9408
LPC(20:3)+H	LPC 20:3	35.9925	78.0500	58.5304	18.0506	34.3635	45.1651	48.7185	32.3278	34.4696	31.5892	74.6610	39.0219	37.2717	22.5599	39.4322	29.8470	30.0599	13.3433	53.6310	53.7990	21.4094	37.4034	71.9362
LPC(20:4)+H	LPC 20:4	938.2366	2866.3534	1421.2587	494.2012	666.3799	916.4398	1068.4847	785.3218	1222.7896	1090.6624	1177.0788	1460.8087	780.4076	571.2905	1076.0956	1390.5801	450.5620	475.1427	1046.8299	1077.5147	535.1412	828.1698	1232.6189
LPC(20:5)+H	LPC 20:5	23.9737	71.0560	35.7694	9.4271	11.9425	17.9501	23.0804	37.0895	167.4025	21.6368	32.6649	19.4408	29.2000	16.9901	51.0341	25.6446	7.8169	7.8780	32.6347	15.0959	10.8656	13.0241	41.7455
LPC(22:4)+H	LPC 22:4	13.9068	26.0506	20.4036	5.6947	12.0365	18.6049	20.1943	13.7496	10.8913	11.0486	16.0548	19.9244	9.3537	3.9727	12.6220	23.5729	10.0148	7.2713	15.0902	19.3666	6.4243	14.9463	24.7704
LPC(22:5)+H	LPC 22:5	112.2235	197.6815	116.8963	44.2666	68.1860	94.1606	158.0453	120.3772	218.8367	83.8928	136.3772	139.0816	104.0706	43.7602	122.7409	137.6643	57.1441	43.9320	157.7852	125.8531	54.3464	94.9967	227.7634
LPC(22:6)+H	LPC 22:6	87.3130	484.0105	198.4444	41.6464	48.1650	144.1293	68.4536	79.1152	332.3950	132.2457	73.0437	146.7060	218.0102	46.9883	191.5068	191.5346	31.1929	25.1623	101.7634	56.0606	71.0598	63.8199	118.5530
PC(14:0_20:4)+HCOO	PC 14:0_20:4	451.3248	41.3520	15.3366	384.9565	388.5285	584.1968	412.4894	233.8037	359.1728	205.7885	635.9985	458.9870	33.6663	1540.3130	41.5442	74.5751	1245.3688	209.3779	97.1932	1247.4835	1114.4028	110.0793	45.7523
PC(15:0_16:0)+HCOO	PC 15:0_16:0	107.9765	39.0308	9.3782	63.5862	194.1973	145.3915	100.0797	45.0159	65.6595	40.1263	75.6359	94.1847	11.6159	208.0242	8.4481	4.5792	355.9164	19.0130	24.6123	335.9266	173.3054	33.3319	29.1250
PC(15:0_18:1)+HCOO	PC 15:0_18:1	854.5055	64.8184	14.4025	369.6389	666.0773	1119.2582	518.2301	199.3346	447.4562	230.5686	458.1635	493.2815	38.5728	1454.6268	50.2463	75.2189	1914.0972	308.3748	120.2054	1383.3905	1730.2118	171.4628	68.1721
PC(15:0_18:2)+HCOO	PC 15:0_18:2	408.9270	27.9179	11.1300	253.9155	894.0036	436.8377	384.6527	166.3315	218.2587	220.5612	177.1124	445.3628	24.7131	770.3905	11.3916	67.1193	1220.2337	162.5652	77.8668	1133.7898	631.3233	64.5216	41.1580
PC(15:0_20:4)+HCOO	PC 15:0_20:4	182.0029	17.4264	4.4913	97.5051	185.2043	153.7631	145.3663	67.2326	115.1143	63.8957	131.7864	171.7612	17.2931	629.7080	8.6832	30.2035	408.9755	92.5655	39.9911	549.0967	397.8744	43.7417	17.2796
PC(16:0_14:0)+HCOO	PC 14:0_16:0	2472.0120	168.5274	52.7672	902.2697	1561.6524	2296.1975	1082.2477	528.3011	1142.7795	943.3669	1988.4190	1453.1185	130.4887	3931.8123	110.6884	268.4753	3985.4913	788.5307	278.7324	4506.4961	2880.2492	363.2538	123.8059
PC(16:0_16:0)+HCOO	PC 16:0/16:0	4663.2110	889.6904	245.4523	1282.0325	6471.3998	4745.6881	2374.3297	1160.0634	2544.7532	2759.8741	3321.7267	4215.0458	492.1770	5341.1543	504.8481	1261.8925	6947.4560	2458.8803	609.6803	11000.2165	3861.8831	1059.5911	361.8681
PC(16:0_16:1)+HCOO	PC 16:0_16:1	4544.1660	273.2615	72.1688	2047.6192	3472.9571	6620.5704	2161.8465	880.6056	1727.9511	1700.3826	3274.2282	2507.8499	123.6456	6225.4643	337.4308	379.9008	7435.3604	1607.1937	366.5693	6707.3229	5657.0736	781.7108	221.8548
PC(16:0_17:0)+HCOO	PC 16:0_17:0	83.3248	12.8055	3.5607	9.5062	62.3335	55.6187	44.8715	14.3048	33.2782	28.1209	35.0955	49.4642	11.2788	63.5742	4.4201	14.8275	89.5488	30.6379	13.3208	137.9755	75.6464	15.5423	8.0499
PC(16:0_18:1)+HCOO	PC 16:0_18:1	26994.9925	2990.8293	551.2021	17431.3221	40141.9882	40078.9305	20308.7277	8016.5520	17325.2026	16168.9506	21339.5255	21796.3147	1249.4252	42139.1126	2991.3517	4755.7846	79127.5231	14942.6836	3782.5584	50909.7278	51670.9864	6439.0766	2222.1802
PC(16:0_18:2)+HCOO	PC 16:0_18:2	24018.4637	2681.1909	781.4931	22913.5626	58557.3830	32692.8622	25273.7535	11086.4118	16116.0557	24586.0046	17944.2812	30354.5657	1490.1943	39510.0716	1702.6281	6162.2527	85543.6420	12529.9291	3724.4879	76620.3721	32716.5984	5184.2183	2644.0810
PC(16:0_20:4)+HCOO	PC 16:0_20:4	13978.1857	1624.5994	428.2362	9933.0124	21235.4967	13130.4802	11136.1566	5035.4163	9056.8622	8585.7798	13877.4034	14687.7458	896.6193	35664.1631	1154.4406	3112.7772	37393.4744	8694.8661	2032.8232	42197.3059	24324.2541	3617.1056	1376.6920
PC(16:0_20:5)+HCOO	PC 16:0_20:5	1458.0146	83.0916	27.0170	572.7491	1334.6224	1260.4187	929.2570	906.3585	2760.5896	655.1834	1421.7764	864.2704	175.5908	3526.4007	175.0482	186.1608	2848.9855	533.8016	192.5602	2945.6896	1690.4485	248.0401	101.1279
PC(16:0_22:4)+HCOO	PC 16:0_22:4	259.5066	34.5956	17.3891	123.6052	397.5783	407.7459	258.4031	105.1451	94.9804	111.8801	311.6877	281.0669	29.1780	283.7863	23.4483	55.4143	960.4750	217.1665	42.6748	1048.2666	451.4285	86.2192	43.9451
PC(16:0_22:6)+HCOO	PC 16:0_22:6	2929.5855	371.8230	106.1089	1286.9683	3519.4252	4426.0389	1549.6283	1160.9611	3409.8405	2132.7682	2190.6399	2928.6532	414.0853	4894.3901	368.8063	667.0248	6566.1354	1185.2859	357.0608	5664.6431	5634.8601	622.3814	207.3138
PC(16:0e_16:0)+HCOO	PC O-16:0/16:0	116.2592	18.0999	10.3920	21.9180	154.1853	158.4525	75.9190	25.2227	47.4086	59.2004	134.8840	98.7552	14.9558	61.2638	14.4605	38.5624	285.0262	55.4788	19.9517	306.9933	97.4631	31.0908	16.4895
PC(16:0e_20:4)+HCOO	PC O-16:0/20:4	1236.3259	90.8989	32.0382	381.6587	2713.9216	1211.5099	1001.1752	306.9763	439.5322	622.6371	751.0516	974.0482	54.0808	946.3567	94.1779	330.4820	2129.3965	405.9652	123.0843	2091.6774	1648.8464	141.2623	88.0447
PC(16:1_20:4)+HCOO	PC 16:1_20:4	387.9092	19.3367	10.2100	154.8200	289.7232	576.7099	202.9096	93.8703	166.6588	120.5838	364.5174	269.8807	17.4005	457.7029	43.8953	26.7607	609.6617	137.0312	35.3911	697.8171	481.4096	87.8280	22.2831
PC(16:1e_18:1)+HCOO	PC O-16:1/18:1	2495.3300	2.8753	0.2947	368.2002	3264.7874	1427.8746	974.0737	147.7667	341.2448	636.0919	679.2777	774.8549	40.6496	3105.7990	115.9480	262.6581	2161.4554	942.0990	135.3512	1756.7838	4021.2225	131.1130	4.3992
PC(16:1e_18:2)+HCOO	PC O-16:1/18:2	4703.7707	3.5294	0.7033	1357.6466	12461.9586	3757.4005	3234.0642	814.0749	1059.4637	2593.0400	2017.6165	3347.7775	105.5463	5748.2162	109.2644	587.6411	8908.2175	2079.8186	348.1435	7938.9382	6026.1421	297.2107	14.0002
PC(16:1e_20:4)+HCOO	PC O-16:1/20:4	52.2753	5.1729	0.7845	68.6213	233.9124	127.9698	65.8923	28.8019	110.5741	80.8491	34.0235	84.8422	6.7181	114.7624	12.5745	21.5111	135.4087	24.4888	9.1685	124.6073	221.7025	9.2421	2.3791
PC(16:1e_22:6)+HCOO	PC O-16:1/22:6	1155.5611	0.9922	0.1042	272.6200	1181.6492	779.1109	397.5150	106.7660	700.0243	522.7600	343.1519	678.5274	41.8130	2822.0698	81.1380	267.3713	848.1594	475.1376	85.4923	1001.3082	2798.4870	91.8218	1.0265
PC(17:0_18:1)+HCOO	PC 17:0_18:1	1128.4379	86.4972	22.9965	336.6921	806.3921	1300.4412	787.7023	238.4382	570.3675	377.5031	541.2141	593.3031	69.6047	1087.5417	85.9367	115.5206	2382.5363	515.9786	148.9401	1569.1414	2309.3593	216.7368	118.8355
PC(17:0_18:2)+HCOO	PC 17:0_18:2	1069.3258	82.0616	41.1249	470.2155	1606.5450	1304.1775	1099.3481	389.3263	572.8564	596.2199	444.7874	936.8811	82.9763	1092.3826	44.2422	157.5343	2878.5058	436.4335	156.8715	2594.3249	1660.1299	172.2834	167.6792
PC(17:0_20:4)+HCOO	PC 17:0_20:4	184.2943	27.3917	6.2470	110.9375	232.3620	193.1835	215.3473	74.4002	146.0386	78.6774	149.2891	173.9815	20.0827	426.5864	12.2917	30.6536	575.6632	133.2073	35.1682	618.9342	482.3148	54.3244	37.0647
PC(18:0_16:0)+HCOO	PC 16:0_18:0	460.1789	95.5447	48.5211	84.4568	414.4018	363.5151	258.7185	102.4001	209.0049	236.2385	337.0743	274.2493	94.5860	242.2903	73.6484	141.2331	601.1635	203.9817	102.1330	890.8426	391.2909	102.8711	86.1374
PC(18:0_18:1)+HCOO	PC 18:0_18:1	2832.3985	365.3737	113.2936	833.3760	2531.8765	3116.0948	1873.9657	631.0381	1481.7253	1367.2085	2149.3425	1590.3957	328.2096	1582.5438	421.4118	439.2623	6401.2983	1988.0544	436.3470	4458.8552	5047.8811	556.4170	469.2435
PC(18:0_20:3)+HCOO	PC 18:0_20:3	332.3597	44.0462	10.2104	143.5271	686.1078	407.3136	258.8832	105.6553	136.6726	150.2456	376.9163	218.9519	41.1216	326.9835	37.2524	45.0817	1154.7680	230.7118	52.7650	939.9074	525.6295	102.2461	44.8934
PC(18:0_20:4)+HCOO	PC 18:0_20:4	1915.0927	339.7758	52.4221	1453.9167	2936.6533	1974.0868	1848.2526	727.8744	1088.7457	992.2670	1900.9444	1914.1751	148.9016	3679.6367	158.7571	547.5427	4805.6370	1765.7639	332.8778	6562.5400	4245.0274	493.4073	241.8148
PC(18:0_22:4)+HCOO	PC 18:0_22:4	52.0530	8.9950	3.6225	19.4567	68.6277	60.2794	43.1801	18.1558	16.1879	21.3236	47.5299	42.8016	7.6491	26.8370	6.6578	12.1316	161.1074	67.7847	8.5767	163.3997	82.3619	14.9573	15.0484
PC(18:0_22:5)+HCOO	PC 18:0_22:5	199.8924	20.2164	3.3796	120.7452	221.7888	149.9432	166.4070	77.6396	119.5552	69.5072	148.1167	141.9610	12.1441	250.1447	14.1137	29.2387	491.0790	169.8350	24.2006	568.3713	316.0692	41.1995	23.2061
PC(18:0e_20:4)+HCOO	PC O-18:0/20:4	107.2416	19.9745	8.4242	34.8588	154.7935	122.6927	114.9375	31.1769	77.6127	86.8781	123.9962	98.6391	16.0609	82.7028	17.0199	56.5045	289.5071	77.6840	26.0901	310.8153	253.2910	22.1989	28.1955
PC(18:1_18:2)+HCOO	PC 18:1_18:2	4559.8960	411.2966	112.0217	3361.1219	9702.1635	6073.1366	2829.0101	1475.4741	1828.7457	2479.4602	2030.7518	3822.5533	148.7701	2478.3434	243.5616	557.8947	9722.4625	1380.5591	360.7118	8410.5416	4928.3741	658.3975	270.0935
PC(18:1_20:4)+HCOO	PC 18:1_20:4	425.2342	43.0660	10.9232	252.3862	406.9158	479.5610	344.4335	189.3727	373.1297	141.4477	499.3886	367.6610	21.7997	588.9222	36.7324	59.0831	1116.1656	231.3599	47.5614	1099.8330	526.9799	90.7541	41.9554
PC(18:1_22:5)+HCOO	PC 18:1_22:5	214.1804	14.9420	2.7334	124.3969	229.2109	163.1785	113.0661	65.0628	102.0247	58.5360	139.1395	140.4704	8.4866	254.9209	16.2797	20.3096	404.0571	104.6332	18.2814	440.6705	274.9045	40.9180	14.6092
PC(18:1_22:6)+HCOO	PC 18:1_22:6	385.6401	43.8102	5.6646	158.7265	379.8542	696.4822	124.5507	104.6099	286.7779	162.7879	205.5075	232.8903	28.7055	303.4736	49.9742	55.2836	651.7297	120.5616	23.0962	433.1677	898.3122	53.9939	14.5798
PC(18:1e_16:0)+HCOO	PC O-18:1/16:0	304.0949	38.1658	16.7826	79.5960	378.2676	459.6838	216.2896	77.2862	128.3090	140.4363	357.8465	205.4333	28.1204	328.2233	41.3220	90.2483	875.2043	211.9238	35.1456	804.5455	623.4979	74.6241	39.6814
PC(18:1e_18:2)+HCOO	PC O-18:1/18:2	428.6935	0.8708	0.0275	48.3946	464.4670	195.4766	130.2381	25.7612	47.5539	122.8784	92.4134	113.0740	6.8769	289.5982	30.9713	36.0388	284.7127	118.1074	12.7156	211.0195	602.2557	17.2347	0.8442
PC(18:1e_20:4)+HCOO	PC O-18:1/20:4	509.7876	81.3002	38.5292	201.6875	608.1333	550.9189	415.2466	149.4440	309.0625	286.9386	428.0789	399.6313	43.4044	557.1542	62.7056	223.5166	1046.2726	278.1642	70.6308	1491.1016	809.0500	134.4964	76.1967
PC(18:2e_20:4)+HCOO	PC O-18:2/20:4	4206.8336	7.8824	0.8168	805.9234	4004.8814	1451.1267	1768.2985	386.1736	992.2212	1691.7357	1306.0260	2060.4343	107.5473	6287.7302	235.8954	678.3328	2830.6217	1721.6603	234.0362	4411.8689	5927.1295	286.9269	11.5275
PC(18:2e_22:5)+HCOO	PC O-18:2/22:5	317.5660	1.0841	0.7737	52.6667	268.0205	87.8449	132.5079	32.0999	77.8167	97.8365	71.5763	116.8648	7.7089	375.0262	17.0209	35.0381	181.9598	117.8058	14.4107	272.0195	404.1396	17.0368	1.4392
PC(18:2e_22:6)+HCOO		322.4636	0.1433	0.0070	58.8128	218.4153	167.8016	68.5479	21.0269	121.8230	128.0653	50.5585	118.8660	10.4259	528.5499	32.1773	60.1255	103.9479	83.0646	13.0423	135.3920	648.5155	14.5631	
PC(19:0_18:1)+HCOO	PC 18:1_19:0	546.1469	12.2831	7.8433	190.4434	992.7513	681.1567	505.7179	162.0462	220.3469	455.6189	304.5729	536.2441	32.6623	212.8062	50.9774	137.7948	1231.6188	217.4008	68.6153	817.7008	941.1571	54.8524	15.7532
PC(19:0_18:2)+HCOO	PC 18:2_19:0	432.8838	7.1525	4.9594	170.9866	682.0315	531.4592	424.4678	119.0944	201.8150	253.1472	460.5142	369.6906	29.4582	394.3376	29.3800	73.2293	1117.6001	162.9301	80.0643	1189.7086	616.9255	82.6425	15.1163
PC(19:0_22:5)+HCOO	PC 19:0_22:5	104.5315	2.2935	1.2629	40.5018	99.6267	71.5687	82.3418	29.4533	88.0178	61.1473	44.9519	74.5815	6.1369	74.4922	8.9583	21.3832	144.7874	36.9666	10.7211	138.0722	147.8230	14.8552	3.9278
PC(19:0_22:6)+HCOO	PC 19:0_22:6	126.1976	4.3117	0.8125	55.4148	112.6729	160.1261	62.8032	27.3147	145.3545	116.1394	42.9933	122.5037	14.0577	106.0647	17.4753	48.1010	105.0301	23.3939	11.2943	115.4709	271.7678	13.6076	2.2923
PC(20:1_18:2)+HCOO	PC 18:2_20:1	275.5154	46.1504	9.1315	173.3764	546.7633	338.7727	270.3795	127.0248	135.6405	178.3694	221.8066	280.0307	26.4805	376.6850	26.0584	72.5114	729.5402	222.7514	40.7489	870.4764	570.8024	71.8116	33.8405
SM(d20:1_16:0)+H	SM 20:1;O2/16:0	206.0939	153.9417	197.9109	5.3641	76.5796	116.5110	89.2384	82.6813	85.2716	148.5283	153.1885	119.1735	180.8704	17.1959	131.2820	114.8348	87.0326	62.7382	186.0524	83.3507	42.2967	126.2709	193.7938
SM(d32:1)+H	SM 32:1;O2	8.8549	6.3260	6.0733	2.0515	4.5867	6.6927	6.0427	6.7619	5.9119	5.3371	9.2271	9.2632	22.3912	4.6398	7.9876	4.7269	4.2572	3.1190	8.4672	7.3488	4.2790	6.2591	5.4775
SM(d32:4)+H	SM 32:4;O2	9.5833	13.9471	7.4600	10.2971	14.5245	9.2502	9.2850	7.8176	8.7831	9.8635	8.6774	9.0823	4.5169	10.3700	12.1871	10.7952	10.5076	7.8936	8.4424	10.6234	7.7338	11.9189	8.5410
SM(d34:0)+H	SM 34:0;O2	19.3218	22.6588	29.5900	0.6601	14.6194	22.3404	14.1659	11.9818	9.6830	15.0830	23.7810	17.6020	17.9306	3.3040	17.1189	23.4462	10.9626	12.9661	15.3855	19.0246	7.6280	40.6815	23.3643
SM(d34:1)+H	SM 34:1;O2	248.3689	234.4656	229.8566	17.9551	203.1694	216.0218	215.0050	192.1521	142.5882	219.2018	299.0839	266.2291	205.4174	62.7273	204.3128	238.2149	164.6205	153.2998	207.6848	266.6166	101.5147	250.6085	229.1575
SM(d34:2)+H	SM 34:2;O2	11.2890	8.4803	10.0631	2.0675	6.3911	9.5391	8.8255	7.8688	7.4562	8.6115	9.9758	12.8860	23.5535	4.4681	7.3454	9.7791	6.9988	5.9255	8.9696	12.2882	4.8796	10.4137	8.0913
SM(d35:1)+H	SM 35:1;O2	17.5233	10.2610	10.1069	0.6399	6.6729	8.0039	9.7790	8.7127	7.4712	7.6069	8.4351	10.6346	19.6501	2.4746	7.2898	7.9775	6.6111	5.6257	14.4270	8.4157	8.5486	10.0739	15.0956
SM(d36:2)+H	SM 36:2;O2	60.4141	32.7775	38.7323	2.7966	23.8680	32.9534	29.9649	27.3419	33.5282	37.5102	38.2948	45.1034	32.4071	8.7343	36.2081	32.4055	26.5401	24.1374	50.2509	27.2608	28.0095	42.1270	36.5180
SM(d37:1)+H	SM 37:1;O2	1.4008	3.8185	4.5676	0.1378	0.6549	1.0942	1.4320	1.4852	0.9977	1.2221	1.2297	1.5099	14.8735	0.4389	1.3535	1.2483	0.9934	0.6706	2.9469	0.9115	2.2942	1.7116	6.6918
SM(d37:2)+H	SM 37:2;O2	4.1612	0.4812	0.8790	0.1050	4.3182	1.3456	2.2102	1.2546	0.7592	2.6317	1.3793	2.4317	2.4608	0.5031	0.9992	2.1509	1.4855	1.8814	2.3167	1.9579	1.6079	0.8659	0.9936
SM(d38:1)+H	SM 38:1;O2	11.4533	36.9531	50.9598	1.1519	7.9460	9.5957	7.7689	9.7729	6.8756	12.0629	15.9365	13.7134	134.1124	1.5930	23.6814	16.0785	8.9808	8.7451	23.8069	6.5772	3.8389	17.0416	53.8215
SM(d38:2)+H	SM 38:2;O2	8.3617	18.4021	20.8995	0.6352	8.4571	7.5739	7.4542	6.8004	8.0881	8.8341	11.0104	13.0099	28.7659	1.3647	11.6656	12.7433	8.8414	11.1458	17.4522	5.4400	6.0417	10.7736	26.8288
SM(d39:1)+H	SM 39:1;O2	1.2787	6.8347	3.9738	0.2403	0.9084	0.8379	0.7694	1.2804	0.7889	1.1871	1.1783	1.8483	32.9630	0.3088	2.3777	1.3153	0.8748	0.9102	3.3142	0.7302	0.5655	1.4196	5.8191
SM(d40:1)+H	SM 40:1;O2	6.6279	72.6196	99.7397	1.7129	6.2611	6.2131	4.9979	10.2176	4.9327	13.4986	12.2395	14.9321	270.0228	1.7148	41.7082	17.0438	6.9320	7.1982	27.1129	7.0116	2.9814	26.4690	78.7904
SM(d40:2)+H	SM 40:2;O2	10.4679	30.1652	40.2611	1.2443	7.0233	7.2128	5.5085	6.9882	6.4097	10.2355	10.7599	15.2562	151.7405	1.5478	20.7658	9.4152	8.4985	11.2386	14.8132	7.1022	4.4972	10.7989	31.9287
SM(d41:1)+H	SM 41:1;O2	1.8127	16.4932	11.7461	0.4846	1.1202	1.4034	0.9028	2.2604	1.2271	3.1508	2.5169	2.2597	110.1586	0.5724	6.0982	3.1832	1.3313	1.3984	8.6670	1.4920	0.8866	4.4585	14.3751
SM(d41:2)+H	SM 41:2;O2	4.9417	12.0248	8.1670	0.4834	2.0160	2.4200	1.9216	2.2794	2.4867	3.5949	3.3387	3.4346	75.5588	0.7658	5.6979	2.8297	2.6304	3.5190	6.6735	2.5550	1.6904	2.9516	12.1431
SM(d42:1)+H	SM 42:1;O2	1.7684	30.6416	25.3526	0.7069	1.4661	1.6769	1.1455	3.3046	1.7034	4.7421	4.1811	3.7532	114.7589	0.6041	17.7799	5.5565	1.7141	1.8289	8.3690	2.0158	0.8749	8.9532	23.0877
SM(d42:2)+H	SM 42:2;O2	34.4965	113.1502	160.2959	2.1862	17.0093	22.6351	16.3780	18.4254	16.1769	47.0342	39.5078	18.6739	600.4212	3.4919	78.8559	30.6657	21.0438	29.4784	37.6174	23.6022	10.8279	30.0830	175.5980
SM(d42:3)+H	SM 42:3;O2	19.4592	29.1906	74.1986	1.0321	10.2938	13.0848	7.9981	8.9479	9.5549	21.4768	17.0716	13.8788	195.8515	1.9652	26.9327	13.1426	10.6746	19.6108	15.8167	12.7896	5.6920	20.0560	46.8368
SM(d42:4)+H	SM 42:4;O2	4.0308	4.3038	12.5034	0.1390	2.3155	2.8510	1.6961	1.8431	1.6937	4.3856	3.2422	3.2398	12.7295	0.2594	3.7924	2.3463	2.0305	3.7489	4.0610	2.8743	1.0667	4.7972	8.8956
SM(d43:2)+H	SM 43:2;O2	0.9348	3.6797	2.5254	0.0903	0.2831	0.4946	0.4721	0.5354	0.5215	0.8490	0.7805	0.5044	16.9499	0.1207	1.1836	0.6770	0.4299	0.5893	1.3341	0.5210	0.5044	0.5331	3.9542
SM(d43:4)+H	SM 43:4;O2	0.5100	4.7707	3.4484	0.1077	0.3149	0.3881	0.2381	0.5571	0.3263	0.8391	0.6830	0.5918	12.1669	0.1445	1.7533	0.8148	0.3392	0.3681	2.2529	0.3933	0.2109	1.2099	3.8111
SM(d43:5)+H	SM 43:5;O2	1.1368	3.2368	1.8486	0.0944	0.4936	0.5469	0.4120	0.4813	0.5549	0.7852	0.7710	0.7630	12.2478	0.1687	1.3497	0.6161	0.5658	0.7458	1.4649	0.5753	0.3508	0.7263	2.5592
SM(d44:4)+H	SM 44:4;O2	0.4509	8.9299	6.7394	0.1744	0.3973	0.4318	0.2810	0.8197	0.4382	1.1956	1.0798	0.9439	14.2185	0.1395	5.0019	1.4189	0.4529	0.4760	2.1737	0.5040	0.1988	2.4596	5.7810
SM(d44:5)+H	SM 44:5;O2	8.2826	36.5043	26.3319	0.6253	4.3307	5.5318	3.7750	4.1905	3.9002	11.1323	9.6624	5.3116	21.3320	0.8355	28.0416	7.2573	4.7874	6.6845	9.3905	5.5806	2.3377	7.7819	44.0839
SM(d44:6)+H	SM 44:6;O2	4.3282	8.5456	12.0524	0.2143	2.4738	2.7921	1.7420	1.8663	2.0685	4.7036	3.8189	3.0530	7.0625	0.4192	7.5131	2.9770	2.2199	4.2465	3.8785	2.7357	1.1985	5.0917	11.0393
SM(t42:1)+H	SM 42:1;O3	0.7848	1.8958	1.9949	0.0471	0.3300	0.4793	0.3853	0.4064	0.3421	0.9211	0.8541	0.5682	7.5367	0.0883	1.3121	0.5134	0.4457	0.6761	0.7805	0.4578	0.3130	0.5115	2.8328
TG(15:0_14:0_16:0)+NH4	TG 14:0_15:0_16:0	54.0680	68.5977	45.5389	56.9840	56.7621	53.2041	48.3182	56.0344	48.9416	54.4473	46.2559	59.6335	41.9677	66.4378	58.7456	55.2430	59.0333	49.0416	43.8575	56.6410	48.2428	45.0896	55.5364
TG(15:0_14:0_16:1)+NH4	TG 14:0_15:0_16:1	22.3748	31.8067	18.1371	24.1240	24.4356	21.9618	22.3868	25.1046	19.1771	21.1471	19.5492	25.9804	16.9419	28.6283	26.5079	24.1567	25.2562	20.2169	20.3204	22.9479	21.7644	18.9892	24.1520
TG(15:0_16:0_16:0)+NH4	TG 15:0_16:0_16:0	53.9496	66.2669	44.6365	57.5072	59.3241	52.1045	49.6660	58.9339	47.8140	53.7346	45.8960	58.1021	66.5412	69.3499	60.6808	55.3054	59.0404	49.2729	43.9943	54.6808	48.1876	45.3183	55.6696
TG(15:0_16:0_16:1)+NH4	TG 15:0_16:0_16:1	62.5180	84.7228	53.5591	67.6867	66.6641	58.4152	62.3519	66.7341	58.4670	64.8434	51.7522	66.3201	58.3281	79.0902	79.7547	70.3824	68.8076	59.7117	52.8103	70.2000	56.7509	55.7421	65.1343
TG(15:0_16:1_16:1)+NH4	TG 15:0_16:1_16:1	29.7658	38.0494	23.3056	33.1925	32.4882	28.0277	27.6678	31.4708	26.2898	28.3671	24.1796	30.6634	22.9956	38.3524	36.3607	30.2740	32.4000	26.7647	25.5681	30.6742	29.3842	25.4724	30.0193
TG(15:0_16:1_18:1)+NH4	TG 15:0_16:1_18:1	98.6899	123.9094	84.5977	101.7805	101.3337	96.6328	87.4360	101.9522	88.5373	98.8232	83.5374	108.5064	87.1414	118.4445	106.6608	98.5613	106.2197	88.3999	79.3608	102.4920	86.3861	82.1907	101.7164
TG(16:0_14:0_14:0)+NH4	TG 14:0_14:0_16:0	28.4990	36.8580	24.2654	30.2759	30.0413	28.0130	25.4524	29.6366	25.8629	28.8691	24.3213	31.5560	23.7974	35.0070	32.0354	28.7434	31.3468	26.1024	22.8264	29.9636	25.2572	24.8660	29.5538
TG(16:0_14:0_16:0)+NH4	TG 14:0_16:0_16:0	51.4995	64.1417	44.9574	52.6920	52.4204	48.5912	46.1641	53.3915	46.6257	52.6603	43.6878	55.6844	48.6361	61.8758	57.1825	52.5732	55.1828	46.3882	42.1916	52.2754	44.0792	41.7379	52.7266
TG(16:0_14:0_16:1)+NH4	TG 14:0_16:0_16:1	86.8503	110.3510	75.1230	91.7146	91.3770	83.4179	77.8243	90.4313	76.8990	86.1275	75.3722	94.2205	87.3073	102.1042	96.8695	88.5196	93.1841	78.8542	70.3893	88.4660	76.0124	72.8995	91.6722
TG(16:0_16:0_16:0)+NH4	TG 16:0/16:0/16:0	93.3829	119.0577	95.5474	112.7400	116.0226	74.1215	83.2303	101.4335	88.5645	92.1984	90.2277	112.8010	93.5093	84.0245	93.5063	98.4269	114.2877	94.2535	58.5678	81.1599	97.6925	62.5895	76.5711
TG(16:0_16:0_16:1)+NH4	TG 16:0_16:0_16:1	101.3708	127.5441	102.6474	96.5838	102.3084	95.2493	83.2040	97.3844	83.8789	103.9028	88.2569	102.7188	176.9647	125.3164	105.0066	99.7383	108.2477	85.6104	79.2332	95.5894	84.5785	82.6461	111.2676
TG(16:0_16:0_17:0)+NH4	TG 16:0_16:0_17:0	39.8143	60.5167	46.2112	34.5105	53.5807	47.9875	34.3391	40.9227	35.0897	37.3969	43.4629	42.6125	42.1380	53.9646	53.1022	50.2799	51.4726	46.4785	29.7342	48.3346	36.7909	33.7755	55.5031
TG(16:0_16:0_18:1)+NH4	TG 16:0_16:0_18:1	102.3224	124.5957	133.0682	85.6764	83.8988	78.4376	89.9867	86.1551	92.0569	113.4122	86.5000	91.4447	375.8788	97.8660	105.4288	113.0007	94.7115	81.2610	93.1599	112.2353	95.7898	95.3502	136.2174
TG(16:0_16:1_17:0)+NH4	TG 16:0_16:1_17:0	71.1036	99.7207	66.1752	81.3639	76.2795	71.3497	66.6713	77.0622	64.2280	71.2607	59.8375	80.5690	82.2122	93.1758	84.2606	78.1305	94.1265	64.9957	59.4656	74.2842	66.9173	61.1599	75.3990
TG(16:0_16:1_18:1)+NH4	TG 16:0_16:1_18:1	105.3147	130.9973	138.5824	89.5377	89.4944	92.9625	85.9764	102.0928	85.6749	102.1115	93.9737	101.8299	340.2273	106.4853	116.6826	96.8754	98.5775	92.6366	83.0091	89.8097	76.9846	81.3640	129.6721
TG(16:0_16:1_24:0)+NH4	TG 16:0_16:1_24:0	14.6321	20.9740	12.4065	15.4992	15.7762	14.3632	13.2604	15.6264	12.9044	14.3915	12.1734	16.4643	10.9807	17.1318	19.3222	14.3136	15.9632	13.7218	13.1385	15.3131	13.3353	11.3755	15.7527
TG(16:0_17:0_18:1)+NH4	TG 16:0_17:0_18:1	43.2099	53.3295	30.9599	45.9822	34.2638	44.1973	31.2447	45.8265	30.6253	44.5649	37.4248	43.0643	54.1333	50.5943	48.9043	31.1675	47.1745	40.9493	28.5720	34.1788	28.9133	34.9351	38.8092
TG(16:0_17:1_18:1)+NH4	TG 16:0_17:1_18:1	47.7185	56.5370	65.9487	45.7302	46.5706	46.2498	40.3397	45.8900	41.4461	45.0813	40.7021	50.5062	78.8974	54.8920	51.9517	44.0946	51.1020	42.1492	37.8215	46.4687	38.8377	38.0813	51.3810
TG(16:0_18:1_18:1)+NH4	TG 16:0_18:1_18:1	177.5654	119.6174	145.0189	71.8872	68.3401	82.6633	77.6487	94.4281	72.0439	84.4846	97.4956	75.8964	780.7214	78.0484	135.4341	98.9653	69.7905	73.4658	71.7592	89.0013	74.4114	60.9432	154.8193
TG(16:0_18:1_20:4)+NH4	TG 16:0_18:1_20:4	14.1447	19.2632	41.1959	12.0400	12.6856	11.0970	10.3103	12.5556	10.3607	13.9843	11.4693	13.4137	165.0407	13.3744	17.5684	13.0565	12.5696	11.6417	11.9159	11.8984	9.8933	10.0131	23.0944
TG(16:0_18:2_18:2)+NH4	TG 16:0_18:2_18:2	11.1170	25.8484	54.5794	17.9455	7.9654	6.3545	6.6181	8.7636	6.6154	10.9348	9.1901	9.0112	129.8925	7.5942	12.1098	16.6609	7.8291	16.9612	8.1894	15.9310	6.5154	7.6697	27.0471
TG(16:1_14:0_14:0)+NH4	TG 14:0_14:0_16:1	12.2510	16.4548	11.9330	13.0272	12.9747	12.4895	11.2431	12.9399	11.4656	11.8236	7.6649	13.4806	17.9197	14.5587	14.8217	12.3139	13.9574	11.0922	10.3785	12.7925	7.3526	11.0997	14.3675
TG(16:1_14:0_16:1)+NH4	TG 14:0_16:1_16:1	18.7747	28.6641	18.2110	22.5127	20.2905	12.7817	17.6110	20.8355	17.9387	17.9440	17.3425	23.1202	12.8403	24.4180	25.0139	21.1690	20.6202	17.8433	17.0311	19.4429	17.7478	17.0953	21.2112
TG(16:1_14:0_18:1)+NH4	TG 14:0_16:1_18:1	65.7619	86.4816	69.2108	67.8518	70.1902	64.6335	59.2263	70.3861	56.7969	65.7332	58.6932	70.0552	101.4287	75.0831	78.6771	66.3061	70.4724	62.6096	53.2116	67.5201	56.1324	57.0831	71.6385
TG(16:1_16:1_16:1)+NH4	TG 16:1/16:1/16:1	16.0052	21.6786	18.7978	16.6622	16.6966	15.3533	14.3051	16.8535	14.0694	15.8997	13.8714	17.3571	29.5726	18.7926	19.6658	16.3077	17.2924	14.9424	13.1678	16.0641	14.0412	13.6274	18.6346
TG(16:1_16:1_17:1)+NH4	TG 16:1_16:1_17:1	16.1454	20.2620	14.3560	18.5242	16.3381	15.3539	13.6962	15.5957	14.3558	16.1902	13.2056	17.5805	15.3394	18.4871	17.4799	15.7878	17.9101	14.2970	12.6360	16.7226	13.6385	13.4214	16.3609
TG(16:1_16:1_18:1)+NH4	TG 16:1_16:1_18:1	39.4145	49.1572	50.3347	34.3302	36.7717	35.7072	30.7477	36.4669	31.7760	34.8698	32.1147	41.4948	97.2448	40.5167	46.4214	35.2663	35.8030	35.0443	33.8488	36.4897	30.0929	30.7297	44.3900
TG(16:1_17:1_18:1)+NH4	TG 16:1_17:1_18:1	23.0223	33.8191	22.6033	23.4727	24.4819	23.0464	24.7195	25.0621	21.5328	23.4611	19.6675	25.1745	35.0709	33.1481	27.2287	24.8163	29.1116	20.2480	19.9629	25.2791	20.0723	19.5902	25.5458
TG(16:1_18:1_18:1)+NH4	TG 16:1_18:1_18:1	66.7897	74.1795	147.0793	55.5196	55.1562	42.8211	39.8472	51.3283	38.4890	57.1809	53.2497	52.1656	480.2619	54.8421	69.2829	46.6758	49.6489	48.5890	46.8172	45.7755	40.7577	40.2534	83.8240
TG(17:0_18:1_18:1)+NH4	TG 17:0_18:1_18:1	19.6377	26.9710	27.6686	19.8738	17.1928	17.4438	16.1399	28.6140	23.4123	23.8416	20.9780	15.4127	43.6061	23.0901	25.3259	22.6771	19.3629	16.3180	14.7639	24.5406	19.4036	13.7544	21.6561
TG(18:0_16:0_16:0)+NH4	TG 16:0_16:0_18:0	49.1336	53.5516	41.3801	43.0271	51.0856	43.2650	41.0968	46.2310	42.3667	46.3399	41.0458	48.2034	40.4047	54.1117	50.2140	38.7105	44.1906	44.8252	25.5520	44.2240	29.3977	39.2478	48.7554
TG(18:0_16:0_18:0)+NH4	TG 16:0_18:0_18:0	21.4161	24.3931	17.9926	21.9468	21.5621	20.9977	18.1556	21.1691	19.3136	21.9940	18.7124	23.2423	14.9975	23.8275	21.4536	20.0425	23.7067	18.9383	16.1185	21.7985	17.8130	18.0721	21.7771
TG(18:0_16:0_18:1)+NH4	TG 16:0_18:0_18:1	45.1468	53.2144	44.4959	37.4037	42.8734	66.1882	37.4548	70.4185	27.7181	42.2046	49.5534	48.2447	125.7896	34.9117	43.0073	45.3596	44.8797	29.9307	36.0357	45.3958	27.9021	38.6587	55.9037
TG(18:0_18:0_18:0)+NH4	TG 18:0/18:0/18:0	14.2760	18.3542	13.6677	15.8004	15.4163	14.4703	12.5659	15.2948	14.1210	14.6452	13.0003	17.3387	11.0636	17.5074	16.9102	15.4038	15.2708	13.4352	12.1456	15.7599	13.3268	11.2353	16.1950
TG(18:0_18:0_18:1)+NH4	TG 18:0_18:0_18:1	17.5786	21.8594	13.9573	19.3516	17.2994	17.4519	12.5650	19.1704	16.2361	16.1908	15.5094	16.3467	22.0439	18.2921	18.9641	19.0572	15.2383	13.1387	13.7618	13.0249	15.7707	14.3586	20.3682
TG(18:0_18:1_18:1)+NH4	TG 18:0_18:1_18:1	43.7449	38.8056	37.4697	29.9331	31.3048	19.5302	26.0885	26.3212	56.8241	26.2525	31.0340	36.1925	170.2810	28.6230	36.1360	28.0747	26.6890	21.1764	28.0866	28.4016	25.0058	24.3064	50.5435
TG(18:1_17:1_18:1)+NH4	TG 17:1_18:1_18:1	21.0957	17.5697	21.3105	18.4125	18.5040	18.2958	17.7151	14.9211	12.4197	21.1114	18.2115	19.8301	39.5569	25.2467	21.5038	20.7916	16.9767	16.1630	11.9860	14.3957	12.1555	11.8491	23.7586
TG(18:1_18:1_18:1)+NH4	TG 18:1/18:1/18:1	67.3189	99.2202	89.7740	51.5420	55.6517	42.0986	39.2727	59.9369	37.7877	44.3914	54.4866	48.8215	589.4067	59.2677	100.8578	52.8921	46.5864	47.9103	49.2312	42.8962	39.5630	36.1165	94.4379
TG(18:1_18:1_18:2)+NH4	TG 18:1_18:1_18:2	58.7676	73.7992	164.4521	40.2020	41.8569	38.2200	35.2235	40.4411	35.2369	48.1102	45.5342	47.2949	962.4225	43.1152	68.3323	47.1047	41.3185	43.2185	45.0679	39.6097	33.0539	32.5337	103.4005
TG(18:1_18:2_18:2)+NH4	TG 18:1_18:2_18:2	9.3943	12.8362	32.4841	8.4741	9.1953	9.4596	9.0397	8.6544	6.8631	10.2893	7.4634	9.5326	123.4943	9.0134	11.2363	8.9824	9.5853	7.7672	7.8354	8.5436	6.1448	7.2174	15.3891
TG(20:0_18:1_18:1)+NH4	TG 18:1_18:1_20:0	11.6964	13.2535	9.6855	14.4111	10.3795	8.3743	8.2732	9.5356	9.7048	8.4847	7.4759	11.7952	13.0893	13.1216	12.3614	8.9197	12.6562	9.3550	8.3270	10.6311	9.5044	9.2506	10.7103
TG(25:0_14:0_16:0)+NH4	TG 14:0_16:0_25:0	11.3004	13.8011	10.6153	12.3504	11.3057	10.5652	8.9454	10.9344	11.2230	12.6494	10.4994	14.1234	9.1005	14.3054	15.4351	10.9172	12.1012	11.2399	10.8399	14.0983	7.2165	9.3704	11.9466
TG(25:0_15:0_16:0)+NH4	TG 15:0_16:0_25:0	11.0367	18.4741	8.4566	12.3818	12.0283	12.0141	10.7349	12.0309	10.2915	10.8553	9.5184	12.2527	8.2164	14.8400	13.9483	12.5516	12.4050	12.0398	11.8356	11.2882	10.7477	9.7127	11.3205
TG(25:0_16:0_16:1)+NH4	TG 16:0_16:1_25:0	10.6507	15.3934	9.5507	11.8033	10.8709	10.3764	9.8213	10.8734	9.3918	10.9787	9.0187	11.5402	8.0746	13.5068	13.0844	10.5232	11.6420	9.7723	8.8441	11.0867	9.4928	8.2442	11.2085