MassBank Record: PR100594



 O-Phospho-L-serine; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: PR100594
RECORD_TITLE: O-Phospho-L-serine; LC-ESI-QTOF; MS2; CE:Ramp 5-60 V; [M-H]-
DATE: 2016.01.19 (2010.06.21, 2011.05.06)
AUTHORS: Matsuda FPlant Science Center, RIKEN., Suzuki MPlant Science Center, RIKEN., Sawada YPlant Science Center, RIKEN., Plant Science Center, RIKEN.
LICENSE: CC BY-SA
COMMENT: Acquisition and generation of the data is financially supported in part by CREST/JST.

CH$NAME: O-Phospho-L-serine CH$NAME: L-SOP CH$NAME: Ser(P) CH$NAME: 3-phosphoserine CH$NAME: Dexfosfoserine CH$NAME: L-2-Amino-3-hydroxypropanoic acid 3-phosphate CH$NAME: L-Serine O-phosphate CH$NAME: Plasmenylserine CH$NAME: Serine phosphate CH$COMPOUND_CLASS: Amino acids 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: CHEMSPIDER 62074 CH$LINK: KAPPAVIEW KPC00185 CH$LINK: KEGG C01005 CH$LINK: KNAPSACK C00007287 CH$LINK: PUBCHEM CID:68841 CH$LINK: INCHIKEY BZQFBWGGLXLEPQ-REOHCLBHSA-N
AC$INSTRUMENT: UPLC Q-Tof Premier, Waters AC$INSTRUMENT_TYPE: LC-ESI-QTOF AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY Ramp 5-60 V AC$MASS_SPECTROMETRY: DATAFORMAT Continuum AC$MASS_SPECTROMETRY: DESOLVATION_GAS_FLOW 600.0 L/Hr AC$MASS_SPECTROMETRY: DESOLVATION_TEMPERATURE 400 C AC$MASS_SPECTROMETRY: FRAGMENTATION_METHOD LOW-ENERGY CID AC$MASS_SPECTROMETRY: IONIZATION ESI AC$MASS_SPECTROMETRY: SOURCE_TEMPERATURE 120 C AC$CHROMATOGRAPHY: CAPILLARY_VOLTAGE 3.0 kV AC$CHROMATOGRAPHY: SAMPLING_CONE 23.0 V AC$CHROMATOGRAPHY: SOLVENT CH3CN(0.1%HCOOH)/ H2O(0.1%HCOOH)
MS$FOCUSED_ION: PRECURSOR_M/Z 184.00112 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-0002-9000000000-f653dafdf17fa74b83a5 PK$NUM_PEAK: 3 PK$PEAK: m/z int. rel.int. 78.9598 20.81 469 96.9693 44.34 999 184.0011 3.896 88 //