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MassBank Record: MSBNK-EPA-ENTACT_AGILENT000579

N-(3-Anilino-2-propenylidene)aniline; ESI-QTOF; MS2; CE: 20; [M+H]+

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-EPA-ENTACT_AGILENT000579
RECORD_TITLE: N-(3-Anilino-2-propenylidene)aniline; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: N-(3-Anilino-2-propenylidene)aniline
CH$NAME: DTXSID4051958
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H14N2
CH$EXACT_MASS: 222.1156984614
CH$SMILES: C(/C=N/C1C=CC=CC=1)/C=N/C1C=CC=CC=1
CH$IUPAC: InChI=1S/C15H14N2/c1-3-8-14(9-4-1)16-12-7-13-17-15-10-5-2-6-11-15/h1-6,8-13H,7H2/b16-12+,17-13+
CH$LINK: CAS 4485-89-6
CH$LINK: INCHIKEY FPKDDRIXOSMQPI-UNZYHPAISA-N

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$FOCUSED_ION: PRECURSOR_M/Z 223.1229749131
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-00e9-0930000000-f687be17d7a17fff4c74
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
  77.038577 12.178948 121
  94.065126 4.301645 42
  104.049476 35.320629 352
  120.080776 41.126712 410
  130.065126 100.000002 999
  131.072951 1.615541 16
  180.080776 1.005425 10
  206.096426 4.853415 48
  223.122975 69.661173 695
//

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