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Details

Stereochemistry RACEMIC
Molecular Formula C11H15NO2
Molecular Weight 193.2423
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl ?-cyano-?-methyl-1-cyclohexene-1-acetate

SMILES

COC(=O)C(C)(C#N)C1=CCCCC1

InChI

InChIKey=AMOPLTIGAMSRMW-UHFFFAOYSA-N
InChI=1S/C11H15NO2/c1-11(8-12,10(13)14-2)9-6-4-3-5-7-9/h6H,3-5,7H2,1-2H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
Methyl ?-cyano-?-methyl-1-cyclohexene-1-acetate
Systematic Name English
1-Cyclohexene-1-acetic acid, ?-cyano-?-methyl-, methyl ester
Preferred Name English
Methyl 2-cyano-2-(cyclohex-1-en-1-yl)-2-methylacetate
Systematic Name English
Code System Code Type Description
FDA UNII
9F2Y9L3XQ8
Created by admin on Wed Apr 02 19:46:16 GMT 2025 , Edited by admin on Wed Apr 02 19:46:16 GMT 2025
PRIMARY
CAS
69016-12-2
Created by admin on Wed Apr 02 19:46:16 GMT 2025 , Edited by admin on Wed Apr 02 19:46:16 GMT 2025
PRIMARY
EPA CompTox
DTXSID20988770
Created by admin on Wed Apr 02 19:46:16 GMT 2025 , Edited by admin on Wed Apr 02 19:46:16 GMT 2025
PRIMARY
PUBCHEM
3017904
Created by admin on Wed Apr 02 19:46:16 GMT 2025 , Edited by admin on Wed Apr 02 19:46:16 GMT 2025
PRIMARY
NIH
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