MassBank Record: KO003784



 O-Phosphoserine; LC-ESI-QQ; MS2; CE:20 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO003784
RECORD_TITLE: O-Phosphoserine; LC-ESI-QQ; MS2; CE:20 V; [M+H]+
DATE: 2016.01.19 (2007.07.07, 2011.05.10)
AUTHORS: Kakazu YInstitute for Advanced Biosciences, Keio Univ., Horai HInstitute for Advanced Biosciences, Keio Univ., Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID P060

CH$NAME: O-Phosphoserine CH$NAME: 3-Phosphoserine CH$NAME: O-Phospho-L-serine CH$NAME: L-O-Phosphoserine CH$COMPOUND_CLASS: N/A CH$FORMULA: C3H8NO6P CH$EXACT_MASS: 185.00892 CH$SMILES: N[C@@H](COP(O)(O)=O)C(O)=O CH$IUPAC: InChI=1S/C3H8NO6P/c4-2(3(5)6)1-10-11(7,8)9/h2H,1,4H2,(H,5,6)(H2,7,8,9)/t2-/m0/s1 CH$LINK: CAS 407-41-0 CH$LINK: CHEBI 15811 CH$LINK: KEGG C01005 CH$LINK: NIKKAJI J136.545B CH$LINK: PUBCHEM SID:4251 CH$LINK: INCHIKEY BZQFBWGGLXLEPQ-REOHCLBHSA-N
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 20 V
MS$FOCUSED_ION: PRECURSOR_M/Z 186 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-000i-9100000000-f86c85cff0432259c764 PK$NUM_PEAK: 27 PK$PEAK: m/z int. rel.int. 50.000 163366.5 15 66.600 54455.5 5 68.800 39604.0 4 70.000 1059407.0 95 76.200 19802.0 2 80.800 178218.0 16 84.900 54455.5 5 85.400 24752.5 2 88.200 11128724.0 999 89.100 19802.0 2 91.100 64356.5 6 93.100 767327.5 69 95.100 153465.5 14 97.900 34653.5 3 105.200 99010.0 9 107.200 485149.0 44 109.100 346535.0 31 113.200 19802.0 2 118.900 39604.0 4 123.100 212871.5 19 132.100 34653.5 3 133.200 400990.5 36 149.900 341584.5 31 151.100 237624.0 21 153.300 14851.5 1 169.100 178218.0 16 186.000 272277.5 24 //