MassBank Record: MSBNK-EPA-ENTACT_AGILENT002040
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
//