U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C14H24O2
Molecular Weight 224.3392
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .BETA.-TERPINYL BUTYRATE, TRANS-

SMILES

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

InChI

InChIKey=UQKCZGATNAIOFP-MQMHXKEQSA-N
InChI=1S/C14H24O2/c1-5-6-13(15)16-14(4)9-7-12(8-10-14)11(2)3/h12H,2,5-10H2,1,3-4H3/t12-,14-

HIDE SMILES / InChI

Approval Year

Name Type Language
.BETA.-TERPINYL BUTYRATE, TRANS-
Common Name English
BUTANOIC ACID, 1-METHYL-4-(1-METHYLETHENYL)CYCLOHEXYL ESTER, TRANS-
Common Name English
(4-ISOPROPENYL-1-METHYL-CYCLOHEXYL) BUTANOATE, TRANS-
Common Name English
FEMA NO. 3049, (.BETA.,TRANS)-
Code English
Code System Code Type Description
FDA UNII
03GE7Y3NKC
Created by admin on Sat Dec 16 00:13:26 GMT 2023 , Edited by admin on Sat Dec 16 00:13:26 GMT 2023
PRIMARY
CAS
93836-73-8
Created by admin on Sat Dec 16 00:13:26 GMT 2023 , Edited by admin on Sat Dec 16 00:13:26 GMT 2023
PRIMARY