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Details

Stereochemistry RACEMIC
Molecular Formula C13H22O
Molecular Weight 194.3132
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NERONE, TRANS-

SMILES

CCC(=O)[C@H]1C[C@@H](CC=C1C)C(C)C

InChI

InChIKey=DZSVIVLGBJKQAP-NEPJUHHUSA-N
InChI=1S/C13H22O/c1-5-13(14)12-8-11(9(2)3)7-6-10(12)4/h6,9,11-12H,5,7-8H2,1-4H3/t11-,12+/m1/s1

HIDE SMILES / InChI

Molecular Formula C13H22O
Molecular Weight 194.3132
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:37:44 GMT 2023
Edited
by admin
on Sat Dec 16 11:37:44 GMT 2023
Record UNII
F1ELS04RTV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NERONE, TRANS-
Common Name English
1-PROPANONE, 1-(2-METHYL-5-(1-METHYLETHYL)-2-CYCLOHEXEN-1-YL)-, TRANS-
Systematic Name English
Code System Code Type Description
PUBCHEM
6992855
Created by admin on Sat Dec 16 11:37:44 GMT 2023 , Edited by admin on Sat Dec 16 11:37:44 GMT 2023
PRIMARY
CAS
41766-71-6
Created by admin on Sat Dec 16 11:37:44 GMT 2023 , Edited by admin on Sat Dec 16 11:37:44 GMT 2023
PRIMARY
FDA UNII
F1ELS04RTV
Created by admin on Sat Dec 16 11:37:44 GMT 2023 , Edited by admin on Sat Dec 16 11:37:44 GMT 2023
PRIMARY