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Details

Stereochemistry ACHIRAL
Molecular Formula C11H17N
Molecular Weight 163.2594
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,6,6-TRIMETHYL-1-CYCLOHEXENE-1-ACETONITRILE

SMILES

CC1=C(CC#N)C(C)(C)CCC1

InChI

InChIKey=UYIKUHRHWRRKCH-UHFFFAOYSA-N
InChI=1S/C11H17N/c1-9-5-4-7-11(2,3)10(9)6-8-12/h4-7H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C11H17N
Molecular Weight 163.2594
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:19:39 GMT 2023
Edited
by admin
on Sat Dec 16 13:19:39 GMT 2023
Record UNII
HXK37M9WGF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,6,6-TRIMETHYL-1-CYCLOHEXENE-1-ACETONITRILE
Systematic Name English
1-CYCLOHEXENE-1-ACETONITRILE, 2,6,6-TRIMETHYL-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
260-822-2
Created by admin on Sat Dec 16 13:19:39 GMT 2023 , Edited by admin on Sat Dec 16 13:19:39 GMT 2023
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FDA UNII
HXK37M9WGF
Created by admin on Sat Dec 16 13:19:39 GMT 2023 , Edited by admin on Sat Dec 16 13:19:39 GMT 2023
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PUBCHEM
93724
Created by admin on Sat Dec 16 13:19:39 GMT 2023 , Edited by admin on Sat Dec 16 13:19:39 GMT 2023
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CAS
57576-15-5
Created by admin on Sat Dec 16 13:19:39 GMT 2023 , Edited by admin on Sat Dec 16 13:19:39 GMT 2023
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EPA CompTox
DTXSID3069196
Created by admin on Sat Dec 16 13:19:39 GMT 2023 , Edited by admin on Sat Dec 16 13:19:39 GMT 2023
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