ACCESSION: MSBNK-EPA-ENTACT_AGILENT001598
RECORD_TITLE: N-(2-Methoxyphenyl)-3-oxobutanamide; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: N-(2-Methoxyphenyl)-3-oxobutanamide
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₃NO₃
CH$EXACT_MASS: 207.089543289
CH$SMILES: CC(=O)CC(=O)NC1C=CC=CC=1OC
CH$IUPAC: InChI=1S/C11H13NO3/c1-8(13)7-11(14)12-9-5-3-4-6-10(9)15-2/h3-6H,7H2,1-2H3,(H,12,14)
CH$LINK: CAS 92-15-9
CH$LINK: INCHIKEY KYYRTDXOHQYZPO-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:7078

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$FOCUSED_ION: PRECURSOR_M/Z 208.0968197407
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-00di-0900000000-0234d150f062b273d24e
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
  43.017841 8.613896 86
  59.049141 1.293349 12
  85.028406 3.141906 31
  109.052215 2.625904 26
  124.07569 100.000005 999
  148.07569 3.295823 32
  150.054955 22.7995 227
  190.086255 8.353603 83
  208.09682 11.657475 116
//