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Details

Stereochemistry RACEMIC
Molecular Formula C13H22O
Molecular Weight 194.3132
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of BETA-IONOL, (Z)-

SMILES

CC(O)\C=C/C1=C(C)CCCC1(C)C

InChI

InChIKey=CNOPDZWOYFOHGN-FPLPWBNLSA-N
InChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8,11,14H,5-6,9H2,1-4H3/b8-7-

HIDE SMILES / InChI

Molecular Formula C13H22O
Molecular Weight 194.3132
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 1
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 00:28:46 GMT 2023
Edited
by admin
on Sat Dec 16 00:28:46 GMT 2023
Record UNII
A00DQN64EO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BETA-IONOL, (Z)-
Common Name English
3-BUTEN-2-OL, 4-(2,6,6-TRIMETHYL-1-CYCLOHEXEN-1-YL)-, (Z)-
Systematic Name English
CIS-.BETA.-IONOL
Common Name English
3-BUTEN-2-OL, 4-(2,6,6-TRIMETHYL-1-CYCLOHEXEN-1-YL)-, (3Z)-
Systematic Name English
(±)-CIS-.BETA.-IONOL
Common Name English
Code System Code Type Description
CAS
35031-11-9
Created by admin on Sat Dec 16 00:28:46 GMT 2023 , Edited by admin on Sat Dec 16 00:28:46 GMT 2023
PRIMARY
PUBCHEM
11264038
Created by admin on Sat Dec 16 00:28:46 GMT 2023 , Edited by admin on Sat Dec 16 00:28:46 GMT 2023
PRIMARY
FDA UNII
A00DQN64EO
Created by admin on Sat Dec 16 00:28:46 GMT 2023 , Edited by admin on Sat Dec 16 00:28:46 GMT 2023
PRIMARY