MassBank Record: KO000309



 (Aminomethyl)phosphonic acid; LC-ESI-QQ; MS2; CE:50 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO000309
RECORD_TITLE: (Aminomethyl)phosphonic acid; LC-ESI-QQ; MS2; CE:50 V; [M-H]-
DATE: 2016.01.19 (Created 2007.07.07, modified 2011.05.10)
AUTHORS: Kakazu Y, Horai H, Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID A235

CH$NAME: (Aminomethyl)phosphonate CH$NAME: 1-Aminomethylphosphonic acid CH$NAME: AMPA CH$NAME: (Aminomethyl)phosphonic acid CH$COMPOUND_CLASS: N/A CH$FORMULA: CH6NO3P CH$EXACT_MASS: 111.00853 CH$SMILES: NCP(O)(O)=O CH$IUPAC: InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5) CH$LINK: CAS 1066-51-9 CH$LINK: KEGG C11033 CH$LINK: NIKKAJI J138.614J CH$LINK: PUBCHEM SID:13216
AC$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 50 V
MS$FOCUSED_ION: PRECURSOR_M/Z 110 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-01t9-9000000000-46a71b7b0105614ea189 PK$NUM_PEAK: 3 PK$PEAK: m/z int. rel.int. 63.000 3222775.5 669 79.000 4811886.0 999 80.300 39604.0 8 //