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Details

Stereochemistry MIXED
Molecular Formula C13H22O3
Molecular Weight 226.312
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CITRAL GLYCERYL ACETAL, (Z)-

SMILES

CC(C)=CCC\C(C)=C/C1OCC(CO)O1

InChI

InChIKey=PARQKBHRABMRKU-XFFZJAGNSA-N
InChI=1S/C13H22O3/c1-10(2)5-4-6-11(3)7-13-15-9-12(8-14)16-13/h5,7,12-14H,4,6,8-9H2,1-3H3/b11-7-

HIDE SMILES / InChI

Molecular Formula C13H22O3
Molecular Weight 226.312
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 01:05:19 GMT 2023
Edited
by admin
on Sat Dec 16 01:05:19 GMT 2023
Record UNII
4S0LI39ONM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CITRAL GLYCERYL ACETAL, (Z)-
Common Name English
1,3-DIOXOLANE-4-METHANOL, 2-((1Z)-2,6-DIMETHYL-1,5-HEPTADIENYL)-
Systematic Name English
(±)-CITRAL GLYCERYL ACETAL, (Z)-
Common Name English
FEMA NO. 4486, Z-
Code English
1,3-DIOXOLANE-4-METHANOL, 2-((1Z)-2,6-DIMETHYL-1,5-HEPTADIEN-1-YL)-
Systematic Name English
Code System Code Type Description
CAS
685559-25-5
Created by admin on Sat Dec 16 01:05:19 GMT 2023 , Edited by admin on Sat Dec 16 01:05:19 GMT 2023
PRIMARY
PUBCHEM
71587781
Created by admin on Sat Dec 16 01:05:19 GMT 2023 , Edited by admin on Sat Dec 16 01:05:19 GMT 2023
PRIMARY
FDA UNII
4S0LI39ONM
Created by admin on Sat Dec 16 01:05:19 GMT 2023 , Edited by admin on Sat Dec 16 01:05:19 GMT 2023
PRIMARY