(2,2,3-trimethylcyclopent-3-en-1-yl)acetonitrile (CHEBI:142078)

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ChEBI Name	(2,2,3-trimethylcyclopent-3-en-1-yl)acetonitrile

ChEBI ID	CHEBI:142078

Definition	A nitrile that is acetonitrile in which one of the hydrogens has been replaced by a 2,2,3-trimethylcyclopent-3-en-1-yl group. A powerful fragrance compound with pine, rosemary and hay-like tonalities.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

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Formula

C10H15N

Net Charge

Average Mass

149.233

Monoisotopic Mass

149.12045

InChI

InChI=1S/C10H15N/c1-8-4-5-9(6-7-11)10(8,2)3/h4,9H,5-6H2,1-3H3

InChIKey

YYJOTFQPYNOYAB-UHFFFAOYSA-N

SMILES

C(#N)CC1C(C(=CC1)C)(C)C

Roles Classification
Application(s):	fragrance A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell.

ChEBI Ontology
Outgoing	(2,2,3-trimethylcyclopent-3-en-1-yl)acetonitrile (CHEBI:142078) has parent hydride cyclopentene (CHEBI:49155) (2,2,3-trimethylcyclopent-3-en-1-yl)acetonitrile (CHEBI:142078) has role fragrance (CHEBI:48318) (2,2,3-trimethylcyclopent-3-en-1-yl)acetonitrile (CHEBI:142078) is a nitrile (CHEBI:18379) (2,2,3-trimethylcyclopent-3-en-1-yl)acetonitrile (CHEBI:142078) is a volatile organic compound (CHEBI:134179)

IUPAC Name

(2,2,3-trimethylcyclopent-3-en-1-yl)acetonitrile

Synonyms	Sources
2-(2,2,3-trimethylcyclopent-3-enyl)ethanenitrile	ChEBI
4-cyanomethyl-5,5-dimethyl-1-methylcyclopent-1-ene	ChEBI

Brand Name	Source
Cantryl	ChEBI

Citation	Type	Source
19781634	PubMed citation	Europe PMC

Last Modified

03 September 2018