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Details

Stereochemistry MIXED
Molecular Formula C10H18S
Molecular Weight 170.315
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,6,6-TRIMETHYLBICYCLO(3.1.1)HEPTANE-1-THIOL

SMILES

CC1CCC2CC1(S)C2(C)C

InChI

InChIKey=YHBWJJQAGNYITO-UHFFFAOYSA-N
InChI=1S/C10H18S/c1-7-4-5-8-6-10(7,11)9(8,2)3/h7-8,11H,4-6H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C10H18S
Molecular Weight 170.315
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:26:48 GMT 2023
Edited
by admin
on Sat Dec 16 18:26:48 GMT 2023
Record UNII
5KME5C6TFK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,6,6-TRIMETHYLBICYCLO(3.1.1)HEPTANE-1-THIOL
Systematic Name English
BICYCLO(3.1.1)HEPTANE-1-THIOL, 2,6,6-TRIMETHYL-
Systematic Name English
Code System Code Type Description
FDA UNII
5KME5C6TFK
Created by admin on Sat Dec 16 18:26:48 GMT 2023 , Edited by admin on Sat Dec 16 18:26:48 GMT 2023
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EPA CompTox
DTXSID40866485
Created by admin on Sat Dec 16 18:26:48 GMT 2023 , Edited by admin on Sat Dec 16 18:26:48 GMT 2023
PRIMARY
PUBCHEM
108342
Created by admin on Sat Dec 16 18:26:48 GMT 2023 , Edited by admin on Sat Dec 16 18:26:48 GMT 2023
PRIMARY
CAS
55511-33-6
Created by admin on Sat Dec 16 18:26:48 GMT 2023 , Edited by admin on Sat Dec 16 18:26:48 GMT 2023
PRIMARY