ACCESSION: MSBNK-EPA-ENTACT_AGILENT001140
RECORD_TITLE: 4-Nitrosodiphenylamine; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 4-Nitrosodiphenylamine
CH$NAME: DTXSID1021031
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₁₀N₂O
CH$EXACT_MASS: 198.0793129561
CH$SMILES: O=NC1C=CC(=CC=1)NC1C=CC=CC=1
CH$IUPAC: InChI=1S/C12H10N2O/c15-14-12-8-6-11(7-9-12)13-10-4-2-1-3-5-10/h1-9,13H
CH$LINK: CAS 156-10-5
CH$LINK: INCHIKEY OIJHFHYPXWSVPF-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:9074

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 20

MS$FOCUSED_ION: PRECURSOR_M/Z 199.0865894078
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-001j-0900000000-b7d1feb8470531065904
PK$NUM_PEAK: 10
PK$PEAK: m/z int. rel.int.
  128.049476 1.328814 13
  130.065126 1.616215 16
  154.065126 1.474176 14
  155.072951 1.34951 13
  168.080776 7.566892 75
  169.088601 18.89332 188
  181.076025 99.999999 999
  182.08385 28.978811 289
  184.07569 1.081216 10
  199.086589 74.094906 740
//