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Details

Stereochemistry RACEMIC
Molecular Formula C11H18O2
Molecular Weight 182.2594
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,6,6-Trimethyl-2-cyclohexene-1-acetic acid

SMILES

CC1=CCCC(C)(C)C1CC(O)=O

InChI

InChIKey=BTSNEEWHODTUJD-UHFFFAOYSA-N
InChI=1S/C11H18O2/c1-8-5-4-6-11(2,3)9(8)7-10(12)13/h5,9H,4,6-7H2,1-3H3,(H,12,13)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
(2,6,6-Trimethyl-2-cyclohexenyl)acetic acid
Preferred Name English
2,6,6-Trimethyl-2-cyclohexene-1-acetic acid
Systematic Name English
2-(2,6,6-Trimethylcyclohex-2-en-1-yl)acetic acid
Systematic Name English
2-Cyclohexene-1-acetic acid, 2,6,6-trimethyl-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID801264407
Created by admin on Wed Apr 02 05:41:49 GMT 2025 , Edited by admin on Wed Apr 02 05:41:49 GMT 2025
PRIMARY
CAS
472-67-3
Created by admin on Wed Apr 02 05:41:49 GMT 2025 , Edited by admin on Wed Apr 02 05:41:49 GMT 2025
PRIMARY
FDA UNII
S4HTH774RW
Created by admin on Wed Apr 02 05:41:49 GMT 2025 , Edited by admin on Wed Apr 02 05:41:49 GMT 2025
PRIMARY
PUBCHEM
10081048
Created by admin on Wed Apr 02 05:41:49 GMT 2025 , Edited by admin on Wed Apr 02 05:41:49 GMT 2025
PRIMARY
NIH
NCATS
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