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Details

Stereochemistry ABSOLUTE
Molecular Formula C12H20O2
Molecular Weight 196.286
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LINALYL ACETATE, (-)-

SMILES

CC(=O)O[C@](C)(CCC=C(C)C)C=C

InChI

InChIKey=UWKAYLJWKGQEPM-LBPRGKRZSA-N
InChI=1S/C12H20O2/c1-6-12(5,14-11(4)13)9-7-8-10(2)3/h6,8H,1,7,9H2,2-5H3/t12-/m0/s1

HIDE SMILES / InChI

Molecular Formula C12H20O2
Molecular Weight 196.286
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 06:02:29 UTC 2023
Edited
by admin
on Sat Dec 16 06:02:29 UTC 2023
Record UNII
J7C5I8LV3G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LINALYL ACETATE, (-)-
Systematic Name English
1,6-OCTADIEN-3-OL, 3,7-DIMETHYL-, ACETATE, (3R)-
Systematic Name English
LINALYL ACETATE R-FORM [MI]
Common Name English
1,6-OCTADIEN-3-OL, 3,7-DIMETHYL-, ACETATE, (-)-
Systematic Name English
L-LINALYL ACETATE
Common Name English
1,6-OCTADIEN-3-OL, 3,7-DIMETHYL-, 3-ACETATE, (3R)-
Common Name English
(-)-LINALYL ACETATE
Systematic Name English
R-(-)-LINALYL ACETATE
Common Name English
1,6-OCTADIEN-3-OL, 3,7-DIMETHYL-, ACETATE, (R)-
Systematic Name English
(R)-LINALYL ACETATE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID801015440
Created by admin on Sat Dec 16 06:02:29 UTC 2023 , Edited by admin on Sat Dec 16 06:02:29 UTC 2023
PRIMARY
ECHA (EC/EINECS)
240-575-7
Created by admin on Sat Dec 16 06:02:29 UTC 2023 , Edited by admin on Sat Dec 16 06:02:29 UTC 2023
PRIMARY
CHEBI
78334
Created by admin on Sat Dec 16 06:02:29 UTC 2023 , Edited by admin on Sat Dec 16 06:02:29 UTC 2023
PRIMARY
MERCK INDEX
m6821
Created by admin on Sat Dec 16 06:02:29 UTC 2023 , Edited by admin on Sat Dec 16 06:02:29 UTC 2023
PRIMARY Merck Index
CAS
16509-46-9
Created by admin on Sat Dec 16 06:02:29 UTC 2023 , Edited by admin on Sat Dec 16 06:02:29 UTC 2023
PRIMARY
PUBCHEM
442474
Created by admin on Sat Dec 16 06:02:29 UTC 2023 , Edited by admin on Sat Dec 16 06:02:29 UTC 2023
PRIMARY
DAILYMED
J7C5I8LV3G
Created by admin on Sat Dec 16 06:02:29 UTC 2023 , Edited by admin on Sat Dec 16 06:02:29 UTC 2023
PRIMARY
RXCUI
2398334
Created by admin on Sat Dec 16 06:02:29 UTC 2023 , Edited by admin on Sat Dec 16 06:02:29 UTC 2023
PRIMARY
FDA UNII
J7C5I8LV3G
Created by admin on Sat Dec 16 06:02:29 UTC 2023 , Edited by admin on Sat Dec 16 06:02:29 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> CONSTITUENT ALWAYS PRESENT
ASSAY (GC)