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Details

Stereochemistry ABSOLUTE
Molecular Formula C7H12O
Molecular Weight 112.1696
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-METHYLCYCLOHEXANONE, (+)-

SMILES

C[C@@H]1CCCC(=O)C1

InChI

InChIKey=UJBOOUHRTQVGRU-ZCFIWIBFSA-N
InChI=1S/C7H12O/c1-6-3-2-4-7(8)5-6/h6H,2-5H2,1H3/t6-/m1/s1

HIDE SMILES / InChI

Molecular Formula C7H12O
Molecular Weight 112.1696
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 21:16:01 GMT 2023
Edited
by admin
on Fri Dec 15 21:16:01 GMT 2023
Record UNII
72794G6S5C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-METHYLCYCLOHEXANONE, (+)-
Systematic Name English
CYCLOHEXANONE, 3-METHYL-, (R)-
Systematic Name English
(3R)-3-METHYLCYCLOHEXANONE, (+)-
Systematic Name English
(3R)-(+)-3-METHYLCYCLOHEXANONE
Systematic Name English
(+)-(3R)-3-METHYLCYCLOHEXANONE
Systematic Name English
(R)-(+)-3-METHYLCYCLOHEXANONE
Systematic Name English
CYCLOHEXANONE, 3-METHYL-, (3R)-
Systematic Name English
(R)-3-METHYLCYCLOHEXANONE
Systematic Name English
(+)-3-METHYL-1-CYCLOHEXANONE
Systematic Name English
Code System Code Type Description
PUBCHEM
83384
Created by admin on Fri Dec 15 21:16:01 GMT 2023 , Edited by admin on Fri Dec 15 21:16:01 GMT 2023
PRIMARY
ECHA (EC/EINECS)
236-438-6
Created by admin on Fri Dec 15 21:16:01 GMT 2023 , Edited by admin on Fri Dec 15 21:16:01 GMT 2023
PRIMARY
CAS
13368-65-5
Created by admin on Fri Dec 15 21:16:01 GMT 2023 , Edited by admin on Fri Dec 15 21:16:01 GMT 2023
PRIMARY
FDA UNII
72794G6S5C
Created by admin on Fri Dec 15 21:16:01 GMT 2023 , Edited by admin on Fri Dec 15 21:16:01 GMT 2023
PRIMARY