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Bicyclo[4.1.0]hept-5-ene-1-acetonitrile, .alpha.-methyl-.alpha.-phenyl-
SpectraBase Compound ID IhCNyTtLazK
InChI InChI=1S/C16H17N/c1-16(11-17,13-7-3-2-4-8-13)15-9-5-6-12-10-14(12)15/h2-4,6-8,14-15H,5,9-10H2,1H3
InChIKey IHFKADTXNVYHAE-UHFFFAOYSA-N
Mol Weight 223.32 g/mol
Molecular Formula C16H17N
Exact Mass 223.1361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 63gfRWouQPN
Name Bicyclo[4.1.0]hept-5-ene-1-acetonitrile, .alpha.-methyl-.alpha.-phenyl-
CAS Registry Number 81652-64-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17N
InChI InChI=1S/C16H17N/c1-16(11-17,13-7-3-2-4-8-13)15-9-5-6-12-10-14(12)15/h2-4,6-8,14-15H,5,9-10H2,1H3
InChIKey IHFKADTXNVYHAE-UHFFFAOYSA-N
Molecular Weight 223.319 g/mol
SMILES C12C(=CCCC2C(C#N)(c2ccccc2)C)C1
SPLASH splash10-0006-9100000000-c9ee05c087f56c349b23
Source of Spectrum F-37-3692-0
Synonyms .alpha.-bicyclo[4.1.0]heptene-5-yl-.alpha.-phenylpropionitrile 2-bicyclo[4.1.0]hept-5-en-2-yl-2-phenylpropanenitrile
Wiley ID 1224280