ACCESSION: MSBNK-EPA-ENTACT_AGILENT001242
RECORD_TITLE: Dimethyl phosphate; ESI-QTOF; MS2; CE: 20; [M-H]-
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: Dimethyl phosphate
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂H₇O₄P
CH$EXACT_MASS: 126.0081952025
CH$SMILES: COP(O)(=O)OC
CH$IUPAC: InChI=1S/C2H7O4P/c1-5-7(3,4)6-2/h1-2H3,(H,3,4)
CH$LINK: CAS 813-78-5
CH$LINK: INCHIKEY KKUKTXOBAWVSHC-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:13134

AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 20

MS$FOCUSED_ION: PRECURSOR_M/Z 125.0009187508
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-004i-9100000000-6b941fc1fe76591bdd18
PK$NUM_PEAK: 10
PK$PEAK: m/z int. rel.int.
  62.964139 50.578544 505
  63.008768 1.109374 11
  78.959054 100.000001 999
  78.995439 4.927287 49
  79.003682 2.696971 26
  79.966879 4.726025 47
  94.990354 1.55537 15
  109.977444 6.492248 64
  110.985269 1.82111 18
  125.000919 14.430819 144
//