MoNA MS database records for Nicotinic acid
Massbank ID | Instrument | Inst. type | MS type | Collision energy | Ion type | Ion mode | MS level |
---|---|---|---|---|---|---|---|
MoNA001864 | Agilent QTOF 6550 | LC-ESI-QTOF | - | 10 | [M+H]+ | positive | MS2 |
MoNA010102 | Agilent 6550 iFunnel | LC-ESI-QTOF | - | 10 | [M+H]+ | Positive | MS2 |
MoNA010105 | Agilent 6550 iFunnel | LC-ESI-QTOF | - | 10 | [M+H]+ | Positive | MS2 |
MoNA011215 | Agilent 6550 iFunnel | Q-TOF | - | 10 | [M+H]+ | positive | - |
MoNA017667 | Agilent 6550 iFunnel | LC-ESI-QTOF | ESI | 10 | [M-H]- | negative | MS2 |
PS007601 | TQD, Waters | Flow-injection QqQ/MS | ESI | 10 | [M+H]+ | positive | MS2 |
FIO00515 | maXis (Bruker Daltonics) | LC-ESI-QTOF | ESI | 10 eV | [M+H]+ | positive | MS2 |
MoNA032098 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 10 eV | [M+H]+ | positive | MS2 |
MoNA032856 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 10 eV | [M+H]+ | positive | MS2 |
MoNA034053 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 10 eV | [M-H]- | negative | MS2 |
MoNA035044 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 10 eV | [M-H]- | negative | MS2 |
KO001502 | API3000, Applied Biosystems | LC-ESI-QQ | - | 10 V | [M-H]- | negative | MS2 |
KO003587 | API3000, Applied Biosystems | LC-ESI-QQ | - | 10 V | [M+H]+ | positive | MS2 |
LU048801 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 15 | [M+H]+ | positive | MS2 |
LU048851 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 15 | [M-H]- | negative | MS2 |
PM018199 | QTOF Premier | Q-TOF | ESI | 15->55V | [M+H]+ | positive | MS2 |
MoNA001862 | Agilent QTOF 6550 | LC-ESI-QTOF | - | 20 | [M+H]+ | positive | MS2 |
MoNA011216 | Agilent 6550 iFunnel | Q-TOF | - | 20 | [M+H]+ | positive | - |
MoNA017668 | Agilent 6550 iFunnel | LC-ESI-QTOF | ESI | 20 | [M-H]- | negative | MS2 |
PS007602 | TQD, Waters | Flow-injection QqQ/MS | ESI | 20 | [M+H]+ | positive | MS2 |
FIO00516 | maXis (Bruker Daltonics) | LC-ESI-QTOF | ESI | 20 eV | [M+H]+ | positive | MS2 |
MoNA032096 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 20 eV | [M+H]+ | positive | MS2 |
MoNA032857 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 20 eV | [M+H]+ | positive | MS2 |
MoNA034052 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 20 eV | [M-H]- | negative | MS2 |
MoNA035049 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 20 eV | [M-H]- | negative | MS2 |
KO001503 | API3000, Applied Biosystems | LC-ESI-QQ | - | 20 V | [M-H]- | negative | MS2 |
KO003588 | API3000, Applied Biosystems | LC-ESI-QQ | - | 20 V | [M+H]+ | positive | MS2 |
EMBL-MCF_spec23374 | Thermo Q-Exactive Plus | LC-ESI-QFT | - | 28.33 eV | [M-H]- | negative | MS2 |
LU048802 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 30 | [M+H]+ | positive | MS2 |
LU048852 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 30 | [M-H]- | negative | MS2 |
MoNA010103 | Agilent 6550 iFunnel | LC-ESI-QTOF | - | 30 | [M+H]+ | Positive | MS2 |
MoNA010106 | Agilent 6550 iFunnel | LC-ESI-QTOF | - | 30 | [M+H]+ | Positive | MS2 |
MoNA011217 | Agilent 6550 iFunnel | Q-TOF | - | 30 | [M+H]+ | positive | - |
PS007603 | TQD, Waters | Flow-injection QqQ/MS | ESI | 30 | [M+H]+ | positive | MS2 |
FIO00517 | maXis (Bruker Daltonics) | LC-ESI-QTOF | ESI | 30 eV | [M+H]+ | positive | MS2 |
KO001504 | API3000, Applied Biosystems | LC-ESI-QQ | - | 30 V | [M-H]- | negative | MS2 |
KO003589 | API3000, Applied Biosystems | LC-ESI-QQ | - | 30 V | [M+H]+ | positive | MS2 |
PR100046 | UPLC Q-Tof Premier, Waters | LC-ESI-QTOF | ESI | 30 V | [M+H]+ | positive | MS2 |
PT100763 | Q-Tof Premier, Waters | LC-Q-TOF/MS | ESI | 30 V | [M+H]+ | positive | MS2 |
VF-NPL-LTQ006446 | Thermo Finnigan LTQ | Linear Ion Trap | - | 35 | M-H | positive | MS2-MS3 Composite |
FiehnHILIC002178 | SCIEX TripleTOF 6600 | LC-ESI-QTOF | - | 35 eV | [M+H]+ | positive | MS2 |
FiehnHILIC002880 | SCIEX TripleTOF 6600 | LC-ESI-QTOF | - | 35 eV | [M-H]- | negative | MS2 |
VF-NPL-QEHF003382 | Thermo Q Exactive HF | ESI-QFT | - | 35HCD | [M-H]- | negative | MS2 |
VF-NPL-QEHF003385 | Thermo Q Exactive HF | ESI-QFT | - | 35HCD | [M+K]+ | positive | MS2 |
VF-NPL-QEHF003388 | Thermo Q Exactive HF | ESI-QFT | - | 35HCD | [M+H]+ | positive | MS2 |
MoNA001865 | Agilent QTOF 6550 | LC-ESI-QTOF | - | 40 | [M+H]+ | positive | MS2 |
MoNA011218 | Agilent 6550 iFunnel | Q-TOF | - | 40 | [M+H]+ | positive | - |
FIO00518 | maXis (Bruker Daltonics) | LC-ESI-QTOF | ESI | 40 eV | [M+H]+ | positive | MS2 |
MoNA032099 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 40 eV | [M+H]+ | positive | MS2 |
MoNA032859 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 40 eV | [M+H]+ | positive | MS2 |
MoNA034059 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 40 eV | [M-H]- | negative | MS2 |
MoNA035048 | Agilent qTOF 6545 | LC-ESI-QTOF | - | 40 eV | [M-H]- | negative | MS2 |
KO001505 | API3000, Applied Biosystems | LC-ESI-QQ | - | 40 V | [M-H]- | negative | MS2 |
KO003590 | API3000, Applied Biosystems | LC-ESI-QQ | - | 40 V | [M+H]+ | positive | MS2 |
LU048803 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 45 | [M+H]+ | positive | MS2 |
LU048853 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 45 | [M-H]- | negative | MS2 |
VF-NPL-QEHF003383 | Thermo Q Exactive HF | ESI-QFT | - | 45HCD | [M-H]- | negative | MS2 |
VF-NPL-QEHF003386 | Thermo Q Exactive HF | ESI-QFT | - | 45HCD | [M+K]+ | positive | MS2 |
VF-NPL-QEHF003389 | Thermo Q Exactive HF | ESI-QFT | - | 45HCD | [M+H]+ | positive | MS2 |
FIO00519 | maXis (Bruker Daltonics) | LC-ESI-QTOF | ESI | 50 eV | [M+H]+ | positive | MS2 |
KO001506 | API3000, Applied Biosystems | LC-ESI-QQ | - | 50 V | [M-H]- | negative | MS2 |
KO003591 | API3000, Applied Biosystems | LC-ESI-QQ | - | 50 V | [M+H]+ | positive | MS2 |
LU048804 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 60 | [M+H]+ | positive | MS2 |
VF-NPL-QEHF003384 | Thermo Q Exactive HF | ESI-QFT | - | 65HCD | [M-H]- | negative | MS2 |
VF-NPL-QEHF003387 | Thermo Q Exactive HF | ESI-QFT | - | 65HCD | [M+K]+ | positive | MS2 |
VF-NPL-QEHF003390 | Thermo Q Exactive HF | ESI-QFT | - | 65HCD | [M+H]+ | positive | MS2 |
MoNA016768 | XEVO-G2S | LC-ESI-QTOF | - | 6V (MS1); Ramp 15V-30V (MSE) | [M+H]+ | positive | - |
LU048805 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 75 | [M+H]+ | positive | MS2 |
LU048806 | Q Exactive Orbitrap (Thermo Sc... | LC-ESI-QFT | ESI | 90 | [M+H]+ | positive | MS2 |
FiehnHILIC000611 | Thermo Q Exactive HF | LC-ESI-QFT | - | HCD (NCE 20-30-40%) | [M+H]+ | positive | MS2 |
FiehnHILIC001394 | Thermo Q Exactive HF | LC-ESI-QFT | - | HCD (NCE 20-30-40%) | [M-H]- | negative | MS2 |
MoNA037165 | Thermo Q Exactive HF | LC-ESI-QFT | - | HCD (NCE 20-30-40%) | [M+H]+ | positive | MS2 |
MoNA037408 | Thermo Q Exactive HF | LC-ESI-QFT | - | HCD (NCE 20-30-40%) | [M+H]+ | positive | MS2 |
MoNA037880 | Thermo Q Exactive HF | LC-ESI-QFT | - | HCD (NCE 20-30-40%) | [M-H]- | negative | MS2 |
MoNA038161 | Thermo Q Exactive HF | LC-ESI-QFT | - | HCD (NCE 20-30-40%) | [M-H]- | negative | MS2 |
MoNA024267 | Thermo Scientific Orbitrap ID-... | LC-ESI-Orbitrap | ESI | HCD (NCE 40%) | [M-H]- | negative | MS2 |
MoNA024299 | Thermo Scientific Orbitrap ID-... | LC-ESI-Orbitrap | ESI | HCD (NCE 40%) | [M+H]+ | positive | MS2 |
PT100760 | Q-Tof Premier, Waters | LC-Q-TOF/MS | ESI | Ramp 5-45 V | [M+H]+ | positive | MS2 |
PT200760 | Q-Tof Premier, Waters | LC-Q-TOF/MS | ESI | Ramp 5-45 V | [M-H]- | negative | MS2 |
PR100045 | UPLC Q-Tof Premier, Waters | LC-ESI-QTOF | ESI | Ramp 5-60 V | [M+H]+ | positive | MS2 |
PR100505 | UPLC Q-Tof Premier, Waters | LC-ESI-QTOF | ESI | Ramp 5-60 V | [M-H]- | negative | MS2 |
Bruker_HCD_library001366 | UPLC Q-Tof Premier, Waters | - | - | - | [M+H]+ | positive | MS2 |
CCMSLIB00000479721 | Orbitrap | - | - | - | [M+H]+ | positive | MS2 |
CCMSLIB00000578103 | Q-Exactive Plus | - | - | - | [M-H]- | negative | MS2 |
CCMSLIB00005464008 | Orbitrap | - | - | - | [M+H]+ | positive | MS2 |
CCMSLIB00005464101 | Orbitrap | - | - | - | [2M-2H+Na]- | negative | MS2 |
CCMSLIB00005720606 | qTof | - | - | - | [M+H]+ | positive | MS2 |
CCMSLIB00005720626 | qTof | - | - | - | [M-H]- | negative | MS2 |
FiehnLib001108 | Leco Pegasus IV | GC-EI-TOF | - | - | - | positive | MS1 |
HMDB0001488_c_ms_1037 | Leco Pegasus IV | GC-MS | - | - | - | - | - |
HMDB0001488_ei_ms_446 | Leco Pegasus IV | - | - | - | - | - | - |
HMDB0001488_ms_ms_1604 | Leco Pegasus IV | Quattro_QQQ | - | - | - | positive | - |
HMDB0001488_ms_ms_1605 | Leco Pegasus IV | Quattro_QQQ | - | - | - | positive | - |
HMDB0001488_ms_ms_1606 | Leco Pegasus IV | Quattro_QQQ | - | - | - | positive | - |
JP005708 | HITACHI M-80 | EI-B | - | - | [M]+* | positive | MS1 |
KZ000065 | Pegasus III TOF-MS system, Lec... | GC-EI-TOF | - | - | - | positive | MS1 |
KZ000167 | Pegasus III TOF-MS system, Lec... | GC-EI-TOF | - | - | - | positive | MS1 |
MoNA010101 | Agilent 6550 iFunnel | LC-ESI-QTOF | - | - | [M+H]+ | Positive | MS2 |
MoNA010104 | Agilent 6550 iFunnel | LC-ESI-QTOF | - | - | [M+H]+ | Positive | MS2 |
MoNA043548 | Orbitrap | - | - | - | M+H | positive | - |
MoNA043550 | Orbitrap | - | - | - | M+H | positive | - |
NUTRI-METAB-FEM-NEG001318 | Orbitrap | - | - | - | M-H | negative | - |
NUTRI-METAB-FEM-NEG001319 | Orbitrap | - | - | - | 2M-2H+Na | negative | - |
NUTRI-METAB-FEM-NEG001320 | Orbitrap | - | - | - | M-H | negative | - |
NUTRI-METAB-FEM-NEG001321 | Orbitrap | - | - | - | 2M-2H+Na | negative | - |
OUF00390 | Pegasus III TOF-MS system, Lec... | GC-EI-TOF | - | - | - | positive | MS1 |
PR010189 | Pegasus III TOF-MS system, Lec... | GC-EI-TOF | - | - | - | positive | MS1 |