MassBank Record: KO000802



 N-Formyl-L-Methionine; LC-ESI-QQ; MS2; CE:40 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO000802
RECORD_TITLE: N-Formyl-L-Methionine; LC-ESI-QQ; MS2; CE:40 V; [M-H]-
DATE: 2016.01.19 (Created 2010.02.10, modified 2011.05.10)
AUTHORS: Kakazu Y, Horai H, Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID F034

CH$NAME: N-Formylmethionine CH$NAME: N-Formyl-L-Methionine CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H11NO3S CH$EXACT_MASS: 177.04596 CH$SMILES: [H]C(=O)N[C@@H](CCSC)C(O)=O CH$IUPAC: InChI=1S/C6H11NO3S/c1-11-3-2-5(6(9)10)7-4-8/h4-5H,2-3H2,1H3,(H,7,8)(H,9,10)/t5-/m0/s1 CH$LINK: KEGG C03145
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 40 V
MS$FOCUSED_ION: PRECURSOR_M/Z 176 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-0002-9000000000-e07240ba0c7d6b253cf3 PK$NUM_PEAK: 20 PK$PEAK: m/z int. rel.int. 32.900 14851.5 1 40.300 163366.5 6 42.100 242574.5 10 44.000 118812.0 5 45.900 173267.5 7 47.100 25292104.5 999 51.900 79208.0 3 54.400 480198.5 19 55.800 29703.0 1 57.200 465347.0 18 58.300 188119.0 7 59.300 138614.0 5 60.800 29703.0 1 65.800 84158.5 3 68.300 89109.0 4 70.100 3475251.0 137 71.500 39604.0 2 82.000 188119.0 7 84.000 603961.0 24 97.800 1757427.5 69 //