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4-Methylcyclohexene

View entire compound with spectra: 9 NMR, 5 FTIR, 15 MS (GC), and 2 Near IR

4-Methylcyclohexene
SpectraBase Compound ID 27By4XcSmTC
InChI InChI=1S/C7H12/c1-7-5-3-2-4-6-7/h2-3,7H,4-6H2,1H3
InChIKey FSWCCQWDVGZMRD-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 B0ij5dv9gbw
Name Cyclohexene, 4-methyl-
CAS Registry Number 591-47-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12
InChI InChI=1S/C7H12/c1-7-5-3-2-4-6-7/h2-3,7H,4-6H2,1H3
InChIKey FSWCCQWDVGZMRD-UHFFFAOYSA-N
Molecular Weight 96.173 g/mol
SMILES CC1CCC=CC1
SPLASH splash10-0fsi-9000000000-d3d7a454ed4ecf25529d
Source of Spectrum NP-16-4595-0
Synonyms 4-Methyl-1-cyclohexene 4-Methylcyclohex-1-ene 4-Methylcyclohexene 4-Methylcyclohexene-1 EINECS 209-715-4 NSC 9386
Wiley ID 1094572