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Details

Stereochemistry ACHIRAL
Molecular Formula C12H22O2
Molecular Weight 198.3019
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of NERAL DIMETHYL ACETAL

SMILES

COC(OC)\C=C(\C)CCC=C(C)C

InChI

InChIKey=ZSKAJFSSXURRGL-LUAWRHEFSA-N
InChI=1S/C12H22O2/c1-10(2)7-6-8-11(3)9-12(13-4)14-5/h7,9,12H,6,8H2,1-5H3/b11-9-

HIDE SMILES / InChI

Molecular Formula C12H22O2
Molecular Weight 198.3019
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:02:58 GMT 2023
Edited
by admin
on Fri Dec 15 18:02:58 GMT 2023
Record UNII
YK1FQU0M59
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NERAL DIMETHYL ACETAL
Systematic Name English
2,6-OCTADIENE, 1,1-DIMETHOXY-3,7-DIMETHYL-, (2Z)-
Systematic Name English
FEMA NO. 2305, Z-
Code English
1,1-DIMETHOXY-3,7-DIMETHYL-OCTA-2,6-DIENE, (2Z)-
Systematic Name English
(2Z)-1,1-DIMETHOXY-3,7-DIMETHYL-OCTA-2,6-DIENE
Systematic Name English
2,6-OCTADIENE, 1,1-DIMETHOXY-3,7-DIMETHYL-, (Z)-
Systematic Name English
Code System Code Type Description
PUBCHEM
5352436
Created by admin on Fri Dec 15 18:02:58 GMT 2023 , Edited by admin on Fri Dec 15 18:02:58 GMT 2023
PRIMARY
FDA UNII
YK1FQU0M59
Created by admin on Fri Dec 15 18:02:58 GMT 2023 , Edited by admin on Fri Dec 15 18:02:58 GMT 2023
PRIMARY
CAS
75128-97-1
Created by admin on Fri Dec 15 18:02:58 GMT 2023 , Edited by admin on Fri Dec 15 18:02:58 GMT 2023
PRIMARY