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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H23NO2
Molecular Weight 261.3593
Optical Activity ( - )
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Menthyl Nicotinate, (-)-

SMILES

CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)C2=CN=CC=C2

InChI

InChIKey=GGOHHUHCISYDOX-VHDGCEQUSA-N
InChI=1S/C16H23NO2/c1-11(2)14-7-6-12(3)9-15(14)19-16(18)13-5-4-8-17-10-13/h4-5,8,10-12,14-15H,6-7,9H2,1-3H3/t12-,14+,15-/m1/s1

HIDE SMILES / InChI

Molecular Formula C16H23NO2
Molecular Weight 261.3593
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:16:51 GMT 2025
Edited
by admin
on Wed Apr 02 19:16:51 GMT 2025
Record UNII
2PXE57RY69
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(-)-Menthyl nicotinate
Preferred Name English
Menthyl Nicotinate, (-)-
Common Name English
3-Pyridinecarboxylic acid, (1R,2S,5R)-5-methyl-2-(1-methylethyl)cyclohexyl ester
Systematic Name English
(1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl 3-pyridinecarboxylate
Systematic Name English
Nicotinyl levomenthol
Common Name English
Code System Code Type Description
PUBCHEM
67659967
Created by admin on Wed Apr 02 19:16:51 GMT 2025 , Edited by admin on Wed Apr 02 19:16:51 GMT 2025
PRIMARY
FDA UNII
2PXE57RY69
Created by admin on Wed Apr 02 19:16:51 GMT 2025 , Edited by admin on Wed Apr 02 19:16:51 GMT 2025
PRIMARY
CAS
133005-61-5
Created by admin on Wed Apr 02 19:16:51 GMT 2025 , Edited by admin on Wed Apr 02 19:16:51 GMT 2025
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER