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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H17N
Molecular Weight 151.2487
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CITRONELLYL NITRILE, (-)-

SMILES

C[C@H](CCC=C(C)C)CC#N

InChI

InChIKey=MTDAKBBUYMYKAR-SNVBAGLBSA-N
InChI=1S/C10H17N/c1-9(2)5-4-6-10(3)7-8-11/h5,10H,4,6-7H2,1-3H3/t10-/m1/s1

HIDE SMILES / InChI

Molecular Formula C10H17N
Molecular Weight 151.2487
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 16:34:15 GMT 2023
Edited
by admin
on Sat Dec 16 16:34:15 GMT 2023
Record UNII
OUQ3V00HYL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CITRONELLYL NITRILE, (-)-
Common Name English
6-OCTENENITRILE, 3,7-DIMETHYL-, (R)-
Systematic Name English
LEVOCITRILE
Common Name English
(3R)-3,7-DIMETHYL-6-OCTENENITRILE
Systematic Name English
6-OCTENENITRILE, 3,7-DIMETHYL-, (3R)-
Systematic Name English
Code System Code Type Description
FDA UNII
OUQ3V00HYL
Created by admin on Sat Dec 16 16:34:15 GMT 2023 , Edited by admin on Sat Dec 16 16:34:15 GMT 2023
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CAS
35931-93-2
Created by admin on Sat Dec 16 16:34:15 GMT 2023 , Edited by admin on Sat Dec 16 16:34:15 GMT 2023
PRIMARY
EPA CompTox
DTXSID101036249
Created by admin on Sat Dec 16 16:34:15 GMT 2023 , Edited by admin on Sat Dec 16 16:34:15 GMT 2023
PRIMARY
PUBCHEM
11789380
Created by admin on Sat Dec 16 16:34:15 GMT 2023 , Edited by admin on Sat Dec 16 16:34:15 GMT 2023
PRIMARY