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2-Cyclohexyl-5-methylbenzonitrile
SpectraBase Compound ID KqxoRBElo4
InChI InChI=1S/C14H17N/c1-11-7-8-14(13(9-11)10-15)12-5-3-2-4-6-12/h7-9,12H,2-6H2,1H3
InChIKey WQHFBXCAGCQMKN-UHFFFAOYSA-N
Mol Weight 199.3 g/mol
Molecular Formula C14H17N
Exact Mass 199.1361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A8lqABsQJUF
Name 2-Cyclohexyl-5-methylbenzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17N
InChI InChI=1S/C14H17N/c1-11-7-8-14(13(9-11)10-15)12-5-3-2-4-6-12/h7-9,12H,2-6H2,1H3
InChIKey WQHFBXCAGCQMKN-UHFFFAOYSA-N
Molecular Weight 199.297 g/mol
SMILES C(c1c(ccc(c1)C)C1CCCCC1)#N
SPLASH splash10-0006-0900000000-b445537ddb791970dd15
Source of Spectrum SK-29-125-2
Synonyms 2-cyclohexyl-5-methyl-benzenecarbonitrile
Wiley ID 880402