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1-Methyl-1-cyclohexene

View entire compound with spectra: 15 NMR, 5 FTIR, 1 Raman, and 12 MS (GC)

1-Methyl-1-cyclohexene
SpectraBase Compound ID LQIhaShskH9
InChI InChI=1S/C7H12/c1-7-5-3-2-4-6-7/h5H,2-4,6H2,1H3
InChIKey CTMHWPIWNRWQEG-UHFFFAOYSA-N
Mol Weight 96.17 g/mol
Molecular Formula C7H12
Exact Mass 96.0939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8RkUBs8EnbU
Name Methylcyclohexene
Carrier Gas Nitrogen
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 96.093900386 u
Formula C7H12
InChI InChI=1S/C7H12/c1-7-5-3-2-4-6-7/h5H,2-4,6H2,1H3
InChIKey CTMHWPIWNRWQEG-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI Psoitive ion
Literature Reference DOI 10.1002/anie.201710074
Molecular Weight 96.173 g/mol
Quality 975
SMILES C1CCCC=C1C
SPLASH splash10-0fsr-9000000000-86cdcaba2a5f38e266b2
Source of Spectrum ACI-57-SM10-Methylcyclohexene (DOI: 10.1002/anie.201710074)
Wiley ID 1891192