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4-Vinyl-1-cyclohexene

View entire compound with spectra: 11 NMR, 7 FTIR, 1 Raman, 16 MS (GC), and 2 Near IR

4-Vinyl-1-cyclohexene
SpectraBase Compound ID Gr0xe9bvymu
InChI InChI=1S/C8H12/c1-2-8-6-4-3-5-7-8/h2-4,8H,1,5-7H2
InChIKey BBDKZWKEPDTENS-UHFFFAOYSA-N
Mol Weight 108.18 g/mol
Molecular Formula C8H12
Exact Mass 108.0939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2R9YfGKBlWr
Name Cyclohexene, 4-ethenyl- (hexadeuterated)
CAS Registry Number 100-40-3
Comments Note: The molecular formula of the structure shown is C8H12 - which differs from the formula reported for the mass spectrum (C8H6D6)
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Formula C8H6D6
InChI InChI=1S/C8H12/c1-2-8-6-4-3-5-7-8/h2-4,8H,1,5-7H2
InChIKey BBDKZWKEPDTENS-UHFFFAOYSA-N
Molecular Weight 108.184 g/mol
SMILES C=CC1CCC=CC1
SPLASH splash10-0hh9-9000000000-d30a53fc7df4679b0cc9
Source of Spectrum HE-1982-0-0
Synonyms 1,2,3,4-Tetrahydrostyrene (hexadeuterated) 1-Cyclohexene, 4-vinyl- (hexadeuterated) 1-Vinyl-3-cyclohexene (hexadeuterated) Cyclohexene, 4-vinyl- (hexadeuterated)
Wiley ID 1122053