ACCESSION: MSBNK-EPA-ENTACT_AGILENT000133
RECORD_TITLE: 3-(Dimethylphosphono)-N-methylolpropionamide; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 3-(Dimethylphosphono)-N-methylolpropionamide
CH$NAME: DTXSID9040215
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₄NO₅P
CH$EXACT_MASS: 211.0609590555
CH$SMILES: COP(=O)(CCC(=O)NCO)OC
CH$IUPAC: InChI=1S/C6H14NO5P/c1-11-13(10,12-2)4-3-6(9)7-5-8/h8H,3-5H2,1-2H3,(H,7,9)
CH$LINK: CAS 20120-33-6
CH$LINK: INCHIKEY MCONGYNHPPCHSD-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:29959

AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 10

MS$FOCUSED_ION: PRECURSOR_M/Z 212.0682355072
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-014i-0900000000-f56effab5648af138437
PK$NUM_PEAK: 7
PK$PEAK: m/z int. rel.int.
  45.033491 4.113068 41
  89.059706 6.550447 65
  109.004907 6.633082 66
  133.085921 1.631386 16
  137.036207 2.245693 22
  165.031122 99.999997 999
  165.07575 1.553135 15
//