ACCESSION: MSBNK-EPA-ENTACT_AGILENT000160
RECORD_TITLE: 4-Anilinophenol; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 4-Anilinophenol
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₁₁NO
CH$EXACT_MASS: 185.0840639806
CH$SMILES: OC1C=CC(=CC=1)NC1C=CC=CC=1
CH$IUPAC: InChI=1S/C12H11NO/c14-12-8-6-11(7-9-12)13-10-4-2-1-3-5-10/h1-9,13-14H
CH$LINK: CAS 122-37-2
CH$LINK: INCHIKEY JTTMYKSFKOOQLP-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:31208

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$FOCUSED_ION: PRECURSOR_M/Z 186.0913404323
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-000i-0900000000-e34daa6f5739e15ad299
PK$NUM_PEAK: 5
PK$PEAK: m/z int. rel.int.
  92.049476 2.969978 29
  93.057301 1.152114 11
  108.04439 2.362702 23
  109.052215 8.659473 86
  186.09134 100.000003 999
//