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MassBank Record: MSBNK-EPA-ENTACT_AGILENT002040

4-Vinylpyridine; 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_AGILENT002040
RECORD_TITLE: 4-Vinylpyridine; ESI-QTOF; MS2; CE: 20; [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 20

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$SPLASH: splash10-0a6r-9800000000-2fbd1bd7371c456f5523
PK$NUM_PEAK: 12
PK$PEAK: m/z int. rel.int.
  44.049476 1.122702 11
  51.022927 5.861586 58
  53.038577 6.231259 62
  67.041651 1.070844 10
  70.065126 1.051149 10
  77.038577 42.039791 419
  78.033826 24.358831 243
  79.041651 1.46424 14
  79.054227 17.385599 173
  80.049476 8.606671 85
  104.049476 1.101627 11
  106.065126 100 999
//

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