MassBank Record: MSBNK-EPA-ENTACT_AGILENT001238
ACCESSION: MSBNK-EPA-ENTACT_AGILENT001238
RECORD_TITLE: Dimethyl phosphate; ESI-QTOF; MS2; CE: 10; [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$MASS_SPECTROMETRY: COLLISION_ENERGY 10
MS$FOCUSED_ION: PRECURSOR_M/Z 125.0009187508
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0
PK$SPLASH: splash10-004i-4900000000-f2a1bb38ab1be69969a8
PK$NUM_PEAK: 5
PK$PEAK: m/z int. rel.int.
62.964139 29.668434 296
78.959054 19.874851 198
94.990354 1.99785 19
109.977444 7.77834 77
125.000919 100.000004 999
//