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Cyclohexaneacetonitrile, .alpha.,.alpha.-dimethyl-4-(1-methylethyl)-, trans-
SpectraBase Compound ID 6iujIfDHTIW
InChI InChI=1S/C13H23N/c1-10(2)11-5-7-12(8-6-11)13(3,4)9-14/h10-12H,5-8H2,1-4H3/t11-,12-
InChIKey QBFZQRNZOWENDU-HAQNSBGRSA-N
Mol Weight 193.33 g/mol
Molecular Formula C13H23N
Exact Mass 193.18305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Knh9plLeass
Name Cyclohexaneacetonitrile, .alpha.,.alpha.-dimethyl-4-(1-methylethyl)-, trans-
CAS Registry Number 85198-25-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H23N
InChI InChI=1S/C13H23N/c1-10(2)11-5-7-12(8-6-11)13(3,4)9-14/h10-12H,5-8H2,1-4H3/t11-,12-
InChIKey QBFZQRNZOWENDU-HAQNSBGRSA-N
Molecular Weight 193.334 g/mol
SMILES C(#N)C([C@]1(CC[C@@](CC1)(C(C)C)[H])[H])(C)C
SPLASH splash10-014i-9000000000-904c04863b745e0c03f6
Source of Spectrum H-65-2708-0
Synonyms 2-(4-isopropylcyclohexyl)-2-methylpropanenitrile trans-7,7-dimethyl-p-menthane-7-carbonitrile
Wiley ID 1189869