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MassBank Record: MSBNK-EPA-ENTACT_AGILENT002038

4-Vinylpyridine; ESI-QTOF; MS2; CE: 40; [M+H]+

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

ACCESSION: MSBNK-EPA-ENTACT_AGILENT002038
RECORD_TITLE: 4-Vinylpyridine; ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 4-Vinylpyridine
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H7N
CH$EXACT_MASS: 105.0578492307
CH$SMILES: C=CC1C=CN=CC=1
CH$IUPAC: InChI=1S/C7H7N/c1-2-7-3-5-8-6-4-7/h2-6H,1H2
CH$LINK: CAS 100-43-6
CH$LINK: INCHIKEY KFDVPJUYSDEJTH-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:7502

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 40

MS$FOCUSED_ION: PRECURSOR_M/Z 106.0651256824
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0udi-9000000000-17826ce036866469ba24
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
  39.022927 1.827222 18
  49.007276 1.006005 10
  50.015101 2.872783 28
  51.022927 100.000003 999
  52.030752 23.474603 234
  53.038577 17.130609 171
  54.033826 1.926681 19
  67.041651 2.688188 26
  77.038577 44.973048 449
  78.033826 9.431887 94
  79.041651 17.933121 179
  80.049476 17.114584 170
  89.038577 1.358118 13
  104.049476 2.00474 20
  106.065126 2.345696 23
//

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