ACCESSION: MSBNK-EPA-ENTACT_AGILENT001664
RECORD_TITLE: 2-Acetamidophenol; ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 2-Acetamidophenol
CH$NAME: DTXSID8022082
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₉NO₂
CH$EXACT_MASS: 151.0633285391
CH$SMILES: CC(=O)NC1C=CC=CC=1O
CH$IUPAC: InChI=1S/C8H9NO2/c1-6(10)9-7-4-2-3-5-8(7)11/h2-5,11H,1H3,(H,9,10)
CH$LINK: CAS 614-80-2
CH$LINK: INCHIKEY ADVGKWPZRIDURE-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:11972

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 40

MS$FOCUSED_ION: PRECURSOR_M/Z 152.0706049908
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-014l-9000000000-5e9d5919ee655cdace31
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  39.022927 16.620507 166
  39.044056 1.013627 10
  43.017841 51.205051 511
  43.041651 1.447967 14
  53.002191 1.210953 12
  53.038577 1.511607 15
  60.04439 1.350871 13
  63.994366 1.404979 14
  65.038577 99.999999 999
  66.033826 1.289605 12
  67.041651 1.084892 10
  92.049476 15.712863 156
  93.033491 4.799566 47
  110.06004 1.676036 16
//