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(E)-[2'-METHYL-2'-(PROP-2''-ENYL)-CYCLOHEXYLIDENE]-ACETONITRILE
SpectraBase Compound ID OEZqpHyQLo
InChI InChI=1S/C12H17N/c1-3-8-12(2)9-5-4-6-11(12)7-10-13/h3,7H,1,4-6,8-9H2,2H3/b11-7+
InChIKey ZILLTZMYPSQFAL-YRNVUSSQSA-N
Mol Weight 175.27 g/mol
Molecular Formula C12H17N
Exact Mass 175.1361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3kA9qks4Om
Name (2E)-2-(2-allyl-2-methyl-cyclohexylidene)acetonitrile
CAS Registry Number 131581-11-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17N
InChI InChI=1S/C12H17N/c1-3-8-12(2)9-5-4-6-11(12)7-10-13/h3,7H,1,4-6,8-9H2,2H3/b11-7+
InChIKey ZILLTZMYPSQFAL-YRNVUSSQSA-N
Molecular Weight 175.275 g/mol
SMILES C(#N)\C=C\1C(CC=C)(C)CCCC1
SPLASH splash10-001i-0900000000-e0841062b16dde196ad9
Source of Spectrum B-43-1323-28
Synonyms (2E)-2-(2-methyl-2-prop-2-enyl-cyclohexylidene)ethanenitrile (2E)-2-(2-methyl-2-prop-2-enylcyclohexylidene)acetonitrile
Wiley ID 1171724