ACCESSION: MSBNK-EPA-ENTACT_AGILENT000437
RECORD_TITLE: 2-(Phenylsulfonyl)aniline; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 2-(Phenylsulfonyl)aniline
CH$NAME: DTXSID0044941
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₁₁NO₂S
CH$EXACT_MASS: 233.0510493329
CH$SMILES: NC1=CC=CC=C1S(=O)(=O)C1C=CC=CC=1
CH$IUPAC: InChI=1S/C12H11NO2S/c13-11-8-4-5-9-12(11)16(14,15)10-6-2-1-3-7-10/h1-9H,13H2
CH$LINK: CAS 4273-98-7
CH$LINK: INCHIKEY JBCUKQQIWSWEOK-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:77956

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$FOCUSED_ION: PRECURSOR_M/Z 234.0583257846
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-053r-4890000000-50d4682ec8565075054d
PK$NUM_PEAK: 7
PK$PEAK: m/z int. rel.int.
  65.038577 1.583589 15
  92.049476 41.708829 416
  93.057301 9.629463 96
  108.04439 17.670638 176
  156.011376 71.370971 712
  156.056966 1.036314 10
  234.058326 100 999
//