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Cyclohexanecarbonitrile, 2-methyl-1-phenyl-, cis-

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Cyclohexanecarbonitrile, 2-methyl-1-phenyl-, cis-
SpectraBase Compound ID DzS93pc01Oz
InChI InChI=1S/C14H17N/c1-12-7-5-6-10-14(12,11-15)13-8-3-2-4-9-13/h2-4,8-9,12H,5-7,10H2,1H3/t12-,14+/m0/s1
InChIKey PDGRHIZRRCNPHL-GXTWGEPZSA-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 8cRzcm018np
Name Cyclohexanecarbonitrile, 2-methyl-1-phenyl-, cis-
Alternate Name(s) (1R,2S)-2-methyl-1-phenylcyclohexanecarbonitrile cis 2-methyl 1-phenyl 1-cyclohexanecarbonitrile
CAS Registry Number 121926-37-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17N
InChI InChI=1S/C14H17N/c1-12-7-5-6-10-14(12,11-15)13-8-3-2-4-9-13/h2-4,8-9,12H,5-7,10H2,1H3/t12-,14+/m0/s1
InChIKey PDGRHIZRRCNPHL-GXTWGEPZSA-N
Molecular Weight 199.297 g/mol
SMILES [C@]1(C#N)(c2ccccc2)[C@@](C)(CCCC1)[H]
SPLASH splash10-004i-0900000000-f54e44e5178daac39ea4
Source of Spectrum I-67-564-75
Wiley ID 1196946