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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H16O2
Molecular Weight 168.2328
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PHELLANDRIC ACID, (R)-

SMILES

CC(C)[C@@H]1CCC(=CC1)C(O)=O

InChI

InChIKey=RVWKOGKZZRIQEW-QMMMGPOBSA-N
InChI=1S/C10H16O2/c1-7(2)8-3-5-9(6-4-8)10(11)12/h5,7-8H,3-4,6H2,1-2H3,(H,11,12)/t8-/m0/s1

HIDE SMILES / InChI

Molecular Formula C10H16O2
Molecular Weight 168.2328
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 Sat Dec 16 15:07:43 GMT 2023
Edited
by admin
on Sat Dec 16 15:07:43 GMT 2023
Record UNII
CC8Y2E143I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PHELLANDRIC ACID, (R)-
Common Name English
1-CYCLOHEXENE-1-CARBOXYLIC ACID, 4-(1-METHYLETHYL)-, (R)-
Systematic Name English
(+)-PHELLANDRIC ACID
Common Name English
(4R)-4-(1-METHYLETHYL)-1-CYCLOHEXENE-1-CARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
FDA UNII
CC8Y2E143I
Created by admin on Sat Dec 16 15:07:44 GMT 2023 , Edited by admin on Sat Dec 16 15:07:44 GMT 2023
PRIMARY
PUBCHEM
130944939
Created by admin on Sat Dec 16 15:07:44 GMT 2023 , Edited by admin on Sat Dec 16 15:07:44 GMT 2023
PRIMARY
CAS
13837-55-3
Created by admin on Sat Dec 16 15:07:44 GMT 2023 , Edited by admin on Sat Dec 16 15:07:44 GMT 2023
PRIMARY