MassBank Record: KO000707



 O-Phosphoethanolamine; 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: KO000707
RECORD_TITLE: O-Phosphoethanolamine; LC-ESI-QQ; MS2; CE:40 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 E009

CH$NAME: Ethanolamine phosphate CH$NAME: O-Phosphoethanolamine CH$NAME: Phosphoethanolamine CH$NAME: O-Phosphorylethanolamine CH$COMPOUND_CLASS: N/A CH$FORMULA: C2H8NO4P CH$EXACT_MASS: 141.01909 CH$SMILES: NCCOP(O)(O)=O CH$IUPAC: InChI=1S/C2H8NO4P/c3-1-2-7-8(4,5)6/h1-3H2,(H2,4,5,6) CH$LINK: CAS 1071-23-4 CH$LINK: CHEBI 17553 CH$LINK: KEGG C00346 CH$LINK: NIKKAJI J12.176B CH$LINK: PUBCHEM SID:3639
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 140 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-004i-9000000000-f573b62dada3630598c3 PK$NUM_PEAK: 3 PK$PEAK: m/z int. rel.int. 63.400 19802.0 1 79.100 26049531.0 999 110.400 24752.5 1 //