ACCESSION: MSBNK-EPA-ENTACT_AGILENT000496
RECORD_TITLE: 3-[Ethyl(phenyl)amino]propanenitrile; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 3-[Ethyl(phenyl)amino]propanenitrile
CH$NAME: DTXSID4044587
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₄N₂
CH$EXACT_MASS: 174.1156984614
CH$SMILES: CCN(CCC#N)C1C=CC=CC=1
CH$IUPAC: InChI=1S/C11H14N2/c1-2-13(10-6-9-12)11-7-4-3-5-8-11/h3-5,7-8H,2,6,10H2,1H3
CH$LINK: CAS 148-87-8
CH$LINK: INCHIKEY WYRNRZQRKCXPLA-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:8995

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$FOCUSED_ION: PRECURSOR_M/Z 175.1229749131
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-004i-0900000000-17bbebc9034bbec4c02b
PK$NUM_PEAK: 6
PK$PEAK: m/z int. rel.int.
  106.065126 26.144222 261
  121.088601 19.999935 199
  134.096426 22.109359 220
  146.08385 3.710816 37
  147.091675 1.65685 16
  175.122975 99.999999 999
//