MoNA MS database records for Melatonin
Massbank ID | Instrument | Inst. type | MS type | Collision energy | Ion type | Ion mode | MS level |
---|---|---|---|---|---|---|---|
LU096151 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 15 | [M-H]- | negative | MS2 |
LU096152 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 30 | [M-H]- | negative | MS2 |
LU096153 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 45 | [M-H]- | negative | MS2 |
LU096154 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 60 | [M-H]- | negative | MS2 |
LU096155 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 75 | [M-H]- | negative | MS2 |
LU096156 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 90 | [M-H]- | negative | MS2 |
LU096101 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 15 | [M+H]+ | positive | MS2 |
LU096102 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 30 | [M+H]+ | positive | MS2 |
LU096103 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 45 | [M+H]+ | positive | MS2 |
LU096104 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 60 | [M+H]+ | positive | MS2 |
LU096105 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 75 | [M+H]+ | positive | MS2 |
LU096106 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 90 | [M+H]+ | positive | MS2 |
MoNA023896 | Thermo Scientific Orbitrap ID-... | LC-ESI-Orbitrap | ESI | HCD (NCE 40%) | [M-H]- | negative | MS2 |
MoNA023858 | Thermo Scientific Orbitrap ID-... | LC-ESI-Orbitrap | ESI | HCD (NCE 40%) | [M+H]+ | positive | MS2 |
PS126301 | TQD, Waters | Flow-injection QqQ/MS | ESI | 10 | [M+H]+ | positive | MS2 |
PS126302 | TQD, Waters | Flow-injection QqQ/MS | ESI | 20 | [M+H]+ | positive | MS2 |
PS126303 | TQD, Waters | Flow-injection QqQ/MS | ESI | 30 | [M+H]+ | positive | MS2 |
PS126304 | TQD, Waters | Flow-injection QqQ/MS | ESI | 40 | [M+H]+ | positive | MS2 |
PS126305 | TQD, Waters | Flow-injection QqQ/MS | ESI | 50 | [M+H]+ | positive | MS2 |
BML00724 | Agilent 1200 RRLC; Agilent 652... | LC-ESI-QTOF | - | 10 ev | [M-H]- | negative | MS2 |
BML00731 | Agilent 1200 RRLC; Agilent 652... | LC-ESI-QTOF | - | 20 ev | [M-H]- | negative | MS2 |
BML00738 | Agilent 1200 RRLC; Agilent 652... | LC-ESI-QTOF | - | 40 ev | [M-H]- | negative | MS2 |
BML81676 | Agilent 1200 RRLC; Agilent 652... | LC-ESI-QTOF | - | - | - | negative | MS1 |
BML81678 | Agilent 1200 RRLC; Agilent 652... | LC-APCI-QTOF | - | - | - | negative | MS1 |
BML00698 | Agilent 1200 RRLC; Agilent 652... | LC-ESI-QTOF | - | 10 ev | [M+H]+ | positive | MS2 |
BML00707 | Agilent 1200 RRLC; Agilent 652... | LC-ESI-QTOF | - | 20 ev | [M+H]+ | positive | MS2 |
BML00716 | Agilent 1200 RRLC; Agilent 652... | LC-ESI-QTOF | - | 40 ev | [M+H]+ | positive | MS2 |
BML81675 | Agilent 1200 RRLC; Agilent 652... | LC-ESI-QTOF | - | - | - | positive | MS1 |
BML81677 | Agilent 1200 RRLC; Agilent 652... | LC-APCI-QTOF | - | - | - | positive | MS1 |
VF-NPL-QTOF004222 | Agilent 6530 Q-TOF | LC-ESI-QTOF | - | 10 V | [M-H]- | negative | MS2 |
VF-NPL-QTOF008425 | Agilent 6530 Q-TOF | LC-ESI-QTOF | - | 10 V | [M-H]- | negative | MS2 |
VF-NPL-QTOF004223 | Agilent 6530 Q-TOF | LC-ESI-QTOF | - | 20 V | [M-H]- | negative | MS2 |
VF-NPL-QTOF008426 | Agilent 6530 Q-TOF | LC-ESI-QTOF | - | 20 V | [M-H]- | negative | MS2 |
VF-NPL-QTOF004224 | Agilent 6530 Q-TOF | LC-ESI-QTOF | - | 40 V | [M-H]- | negative | MS2 |
VF-NPL-QTOF008427 | Agilent 6530 Q-TOF | LC-ESI-QTOF | - | 40 V | [M-H]- | negative | MS2 |
VF-NPL-QTOF004219 | Agilent 6530 Q-TOF | LC-ESI-QTOF | - | 10 V | [M+H]+ | positive | MS2 |
VF-NPL-QTOF008422 | Agilent 6530 Q-TOF | LC-ESI-QTOF | - | 10 V | [M+H]+ | positive | MS2 |
VF-NPL-QTOF004220 | Agilent 6530 Q-TOF | LC-ESI-QTOF | - | 20 V | [M+H]+ | positive | MS2 |
VF-NPL-QTOF008423 | Agilent 6530 Q-TOF | LC-ESI-QTOF | - | 20 V | [M+H]+ | positive | MS2 |
VF-NPL-QTOF004221 | Agilent 6530 Q-TOF | LC-ESI-QTOF | - | 40 V | [M+H]+ | positive | MS2 |
VF-NPL-QTOF008424 | Agilent 6530 Q-TOF | LC-ESI-QTOF | - | 40 V | [M+H]+ | positive | MS2 |
VF-NPL-QTOF008421 | Agilent 6530 Q-TOF | LC-ESI-QTOF | - | 10 V | [M+Na]+ | positive | MS2 |
MoNA034336 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 10 eV | [M-H]- | negative | MS2 |
MoNA035015 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 10 eV | [M-H]- | negative | MS2 |
MoNA034337 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 20 eV | [M-H]- | negative | MS2 |
MoNA035013 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 20 eV | [M-H]- | negative | MS2 |
MoNA034338 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 40 eV | [M-H]- | negative | MS2 |
MoNA035019 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 40 eV | [M-H]- | negative | MS2 |
MoNA032336 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 10 eV | [M+H]+ | positive | MS2 |
MoNA032839 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 10 eV | [M+H]+ | positive | MS2 |
MoNA036232 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 10 eV | [M+H]+ | positive | MS2 |
MoNA032339 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 20 eV | [M+H]+ | positive | MS2 |
MoNA032840 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 20 eV | [M+H]+ | positive | MS2 |
MoNA036234 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 20 eV | [M+H]+ | positive | MS2 |
MoNA032338 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 40 eV | [M+H]+ | positive | MS2 |
MoNA032842 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 40 eV | [M+H]+ | positive | MS2 |
MoNA036233 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 40 eV | [M+H]+ | positive | MS2 |
MoNA036228 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 10 eV | [M+NH4]+ | positive | MS2 |
MoNA036964 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 10 eV | [M+NH4]+ | positive | MS2 |
MoNA036229 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 20 eV | [M+NH4]+ | positive | MS2 |
MoNA036967 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 20 eV | [M+NH4]+ | positive | MS2 |
MoNA036231 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 40 eV | [M+NH4]+ | positive | MS2 |
MoNA036966 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 40 eV | [M+NH4]+ | positive | MS2 |
MoNA002180 | Agilent QTOF 6550 | LC-ESI-QTOF | - | 10 | [M+H]+ | positive | MS2 |
MoNA002182 | Agilent QTOF 6550 | LC-ESI-QTOF | - | 20 | [M+H]+ | positive | MS2 |
MoNA002183 | Agilent QTOF 6550 | LC-ESI-QTOF | - | 40 | [M+H]+ | positive | MS2 |
KO001411 | API3000, Applied Biosystems | LC-ESI-QQ | - | 10 V | [M-H]- | negative | MS2 |
KO001407 | API3000, Applied Biosystems | LC-ESI-QQ | - | 20 V | [M-H]- | negative | MS2 |
KO001408 | API3000, Applied Biosystems | LC-ESI-QQ | - | 30 V | [M-H]- | negative | MS2 |
KO001409 | API3000, Applied Biosystems | LC-ESI-QQ | - | 40 V | [M-H]- | negative | MS2 |
KO001410 | API3000, Applied Biosystems | LC-ESI-QQ | - | 50 V | [M-H]- | negative | MS2 |
KO003432 | API3000, Applied Biosystems | LC-ESI-QQ | - | 10 V | [M+H]+ | positive | MS2 |
KO003433 | API3000, Applied Biosystems | LC-ESI-QQ | - | 20 V | [M+H]+ | positive | MS2 |
KO003434 | API3000, Applied Biosystems | LC-ESI-QQ | - | 30 V | [M+H]+ | positive | MS2 |
KO003435 | API3000, Applied Biosystems | LC-ESI-QQ | - | 40 V | [M+H]+ | positive | MS2 |
KO003436 | API3000, Applied Biosystems | LC-ESI-QQ | - | 50 V | [M+H]+ | positive | MS2 |
KO009065 | LC/MSD Trap XCT, Agilent Techn... | LC-ESI-IT | - | 0.6 | [M+H]+ | positive | MS2 |
KO009066 | LC/MSD Trap XCT, Agilent Techn... | LC-ESI-IT | - | 0.60/0.65 | [M+H]+ | positive | MS3 |
FiehnLib000972 | Leco Pegasus IV | GC-EI-TOF | - | - | - | positive | MS1 |
FiehnLib000973 | Leco Pegasus IV | GC-EI-TOF | - | - | - | positive | MS1 |
FiehnLib000974 | Leco Pegasus IV | GC-EI-TOF | - | - | - | positive | MS1 |
CCMSLIB00005464361 | Orbitrap | - | - | - | [M-H]- | negative | MS2 |
NUTRI-METAB-FEM-NEG002080 | Orbitrap | - | - | - | M-H | negative | - |
NUTRI-METAB-FEM-NEG002081 | Orbitrap | - | - | - | M-H | negative | - |
NUTRI-METAB-FEM-NEG002082 | Orbitrap | - | - | - | M-H | negative | - |
NUTRI-METAB-FEM-NEG002083 | Orbitrap | - | - | - | M-H | negative | - |
NUTRI-METAB-FEM-NEG002084 | Orbitrap | - | - | - | M-H | negative | - |
NUTRI-METAB-FEM-NEG002085 | Orbitrap | - | - | - | M-H | negative | - |
MoNA043340 | Orbitrap | - | - | - | 2M+H | positive | - |
MoNA043346 | Orbitrap | - | - | - | 2M+H | positive | - |
CCMSLIB00005464420 | Orbitrap | - | - | - | [2M+Na]+ | positive | MS2 |
MoNA043345 | Orbitrap | - | - | - | 2M+Na | positive | - |
MoNA043349 | Orbitrap | - | - | - | 2M+Na | positive | - |
CCMSLIB00005464419 | Orbitrap | - | - | - | [M+H]+ | positive | MS2 |
MoNA043339 | Orbitrap | - | - | - | M+H | positive | - |
MoNA043341 | Orbitrap | - | - | - | M+H | positive | - |
MoNA043342 | Orbitrap | - | - | - | M+H | positive | - |
MoNA043343 | Orbitrap | - | - | - | M+H | positive | - |
MoNA043344 | Orbitrap | - | - | - | M+H | positive | - |
MoNA043347 | Orbitrap | - | - | - | M+H | positive | - |
CCMSLIB00005464421 | Orbitrap | - | - | - | [M+Na]+ | positive | MS2 |
CCMSLIB00000578306 | Q-Exactive Plus | - | - | - | [M-H]- | negative | MS2 |
CCMSLIB00000578055 | Q-Exactive Plus | - | - | - | [M+H]+ | positive | MS2 |
CCMSLIB00005720796 | qTof | - | - | - | [M-H]- | negative | MS2 |
CCMSLIB00000078045 | qTof | - | - | - | [M+H]+ | positive | MS2 |
CCMSLIB00000081598 | qTof | - | - | - | [M+H]+ | positive | MS2 |
CCMSLIB00005720504 | qTof | - | - | - | [M+H]+ | positive | MS2 |
CCMSLIB00005721091 | qTof | - | - | - | [M+H]+ | positive | MS2 |
CCMSLIB00000081599 | qTof | - | - | - | [M+Na]+ | positive | MS2 |
FiehnHILIC002816 | SCIEX TripleTOF 6600 | LC-ESI-QTOF | - | 35 eV | [M-H]- | negative | MS2 |
FiehnHILIC002079 | SCIEX TripleTOF 6600 | LC-ESI-QTOF | - | 35 eV | [M+H]+ | positive | MS2 |
VF-NPL-LTQ007530 | Thermo Finnigan LTQ | Linear Ion Trap | - | 35 | M-H | negative | MS2-MS3 Composite |
VF-NPL-LTQ007527 | Thermo Finnigan LTQ | Linear Ion Trap | - | 35 | M-H | positive | MS2 |
VF-NPL-LTQ007528 | Thermo Finnigan LTQ | Linear Ion Trap | - | 35 | M-H | positive | MS2-MS3 Composite |
VF-NPL-QEHF026302 | Thermo Q Exactive HF | ESI-QFT | - | 35HCD | [M-H]- | negative | MS2 |
VF-NPL-QEHF026303 | Thermo Q Exactive HF | ESI-QFT | - | 45HCD | [M-H]- | negative | MS2 |
VF-NPL-QEHF026304 | Thermo Q Exactive HF | ESI-QFT | - | 65HCD | [M-H]- | negative | MS2 |
FiehnHILIC001318 | Thermo Q Exactive HF | LC-ESI-QFT | - | HCD (NCE 20-30-40%) | [M-H]- | negative | MS2 |
MoNA037981 | Thermo Q Exactive HF | LC-ESI-QFT | - | HCD (NCE 20-30-40%) | [M-H]- | negative | MS2 |
MoNA038151 | Thermo Q Exactive HF | LC-ESI-QFT | - | HCD (NCE 20-30-40%) | [M-H]- | negative | MS2 |
VF-NPL-QEHF026299 | Thermo Q Exactive HF | ESI-QFT | - | 35HCD | [M+H]+ | positive | MS2 |
VF-NPL-QEHF026300 | Thermo Q Exactive HF | ESI-QFT | - | 45HCD | [M+H]+ | positive | MS2 |
VF-NPL-QEHF026301 | Thermo Q Exactive HF | ESI-QFT | - | 65HCD | [M+H]+ | positive | MS2 |
FiehnHILIC000507 | Thermo Q Exactive HF | LC-ESI-QFT | - | HCD (NCE 20-30-40%) | [M+H]+ | positive | MS2 |
MoNA037252 | Thermo Q Exactive HF | LC-ESI-QFT | - | HCD (NCE 20-30-40%) | [M+H]+ | positive | MS2 |
MoNA037403 | Thermo Q Exactive HF | LC-ESI-QFT | - | HCD (NCE 20-30-40%) | [M+H]+ | positive | MS2 |
MoNA038625 | Thermo Q Exactive HF | LC-ESI-QFT | - | HCD (NCE 20-30-40%) | [M+H]+ | positive | MS2 |
MoNA038720 | Thermo Q Exactive HF | LC-ESI-QFT | - | HCD (NCE 20-30-40%) | [M+H]+ | positive | MS2 |
VF-NPL-QEHF026308 | Thermo Q Exactive HF | ESI-QFT | - | 35HCD | [M+K]+ | positive | MS2 |
VF-NPL-QEHF026309 | Thermo Q Exactive HF | ESI-QFT | - | 45HCD | [M+K]+ | positive | MS2 |
VF-NPL-QEHF026310 | Thermo Q Exactive HF | ESI-QFT | - | 65HCD | [M+K]+ | positive | MS2 |
VF-NPL-QEHF026305 | Thermo Q Exactive HF | ESI-QFT | - | 35HCD | [M+Na]+ | positive | MS2 |
VF-NPL-QEHF026306 | Thermo Q Exactive HF | ESI-QFT | - | 45HCD | [M+Na]+ | positive | MS2 |
VF-NPL-QEHF026307 | Thermo Q Exactive HF | ESI-QFT | - | 65HCD | [M+Na]+ | positive | MS2 |
VF-NPL-QEHF026311 | Thermo Q Exactive HF | ESI-QFT | - | 35HCD | [M+NH4]+ | positive | MS2 |
VF-NPL-QEHF026312 | Thermo Q Exactive HF | ESI-QFT | - | 45HCD | [M+NH4]+ | positive | MS2 |
VF-NPL-QEHF026313 | Thermo Q Exactive HF | ESI-QFT | - | 65HCD | [M+NH4]+ | positive | MS2 |
MoNA038629 | Thermo Q Exactive HF | LC-ESI-QFT | - | HCD (NCE 20-30-40%) | [M+NH4]+ | positive | MS2 |
MoNA038717 | Thermo Q Exactive HF | LC-ESI-QFT | - | HCD (NCE 20-30-40%) | [M+NH4]+ | positive | MS2 |
EMBL-MCF_spec69204 | Thermo Q-Exactive Plus | LC-ESI-QFT | - | 35.0 eV | [M-H]- | negative | MS2 |
EMBL-MCF_spec138132 | Thermo Q-Exactive Plus | LC-ESI-QFT | - | 35.0 eV | [M+H]+ | positive | MS2 |
EMBL-MCF_spec138151 | Thermo Q-Exactive Plus | LC-ESI-QFT | - | 35.0 eV | [M+H]+ | positive | MS2 |
EMBL-MCF_spec138137 | Thermo Q-Exactive Plus | LC-ESI-QFT | - | 35.0 eV | [M+Na]+ | positive | MS2 |
EMBL-MCF_spec138138 | Thermo Q-Exactive Plus | LC-ESI-QFT | - | 35.0 eV | [M+NH4]+ | positive | MS2 |
MoNA016612 | XEVO-G2S | LC-ESI-QTOF | - | 6V (MS1); Ramp 15V-30V (MSE) | [2M+Na]+ | positive | - |
MoNA016758 | XEVO-G2S | LC-ESI-QTOF | - | 6V (MS1); Ramp 15V-30V (MSE) | [M+H]+ | positive | - |
MoNA016900 | XEVO-G2S | LC-ESI-QTOF | - | 6V (MS1); Ramp 15V-30V (MSE) | [M+Na]+ | positive | - |
HMDB0001389_ms_ms_1547 | XEVO-G2S | Quattro_QQQ | - | - | - | positive | - |
HMDB0001389_ms_ms_1548 | XEVO-G2S | Quattro_QQQ | - | - | - | positive | - |
HMDB0001389_ms_ms_1549 | XEVO-G2S | Quattro_QQQ | - | - | - | positive | - |
BAF_UVA_POS000319 | XEVO-G2S | - | - | - | - | - | - |
BAF_UVA_POS000320 | XEVO-G2S | - | - | - | - | - | - |
BAF_UVA_POS000321 | XEVO-G2S | - | - | - | - | - | - |
BAF_UVA_POS000322 | XEVO-G2S | - | - | - | - | - | - |
HMDB0001389_c_ms_1945 | XEVO-G2S | GC-MS | - | - | - | - | - |
HMDB0001389_ei_ms_505 | XEVO-G2S | - | - | - | - | - | - |