2,6,6-TRIMETHYL-1-CYCLOHEXENE-1-ACETONITRILE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H17N
Molecular Weight	163.2594
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,6,6-TRIMETHYL-1-CYCLOHEXENE-1-ACETONITRILE

Structure Search

SMILES

CC1=C(CC#N)C(C)(C)CCC1

InChI

InChIKey=UYIKUHRHWRRKCH-UHFFFAOYSA-N

InChI=1S/C11H17N/c1-9-5-4-7-11(2,3)10(9)6-8-12/h4-7H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C11H17N
Molecular Weight	163.2594
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 20:31:51 GMT 2025` Edited by `admin` on `Tue Apr 01 20:31:51 GMT 2025`
Record UNII	HXK37M9WGF
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

2,6,6-TRIMETHYL-1-CYCLOHEXENE-1-ACETONITRILE

Systematic Name

English

1-CYCLOHEXENE-1-ACETONITRILE, 2,6,6-TRIMETHYL-

Preferred Name

English

Code System Code Type Description

ECHA (EC/EINECS)

260-822-2

Created by admin on Tue Apr 01 20:31:51 GMT 2025 , Edited by admin on Tue Apr 01 20:31:51 GMT 2025

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FDA UNII

HXK37M9WGF

Created by admin on Tue Apr 01 20:31:51 GMT 2025 , Edited by admin on Tue Apr 01 20:31:51 GMT 2025

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PUBCHEM

93724

Created by admin on Tue Apr 01 20:31:51 GMT 2025 , Edited by admin on Tue Apr 01 20:31:51 GMT 2025

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CAS

57576-15-5

Created by admin on Tue Apr 01 20:31:51 GMT 2025 , Edited by admin on Tue Apr 01 20:31:51 GMT 2025

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EPA CompTox

DTXSID3069196

Created by admin on Tue Apr 01 20:31:51 GMT 2025 , Edited by admin on Tue Apr 01 20:31:51 GMT 2025

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