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3-(2-Methylphenyl)cyclohexene
SpectraBase Compound ID 9DmcmLvapeW
InChI InChI=1S/C13H16/c1-11-7-5-6-10-13(11)12-8-3-2-4-9-12/h3,5-8,10,12H,2,4,9H2,1H3
InChIKey OSOBNOXOQRTMFA-UHFFFAOYSA-N
Mol Weight 172.27 g/mol
Molecular Formula C13H16
Exact Mass 172.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8NGCCHuXOa0
Name 3-(2-Methylphenyl)cyclohexene
Alternate Name(s) 1-(2-cyclohexen-1-yl)-2-methylbenzene 1-(Cyclohex-2-enyl)-2-methylbenzene 2'-methyl-1,2,3,4-tetrahydro-1,1'-biphenyl
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16
InChI InChI=1S/C13H16/c1-11-7-5-6-10-13(11)12-8-3-2-4-9-12/h3,5-8,10,12H,2,4,9H2,1H3
InChIKey OSOBNOXOQRTMFA-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol400056z
Molecular Weight 172.271 g/mol
SMILES C1=CCCCC1c1c(cccc1)C
SPLASH splash10-004l-3900000000-845a0db3fad137ca54c8
Source of Spectrum A1-15-714/SMS13-Table2,entry4
Wiley ID 1748379