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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 10-MERCAPTOPINANE

SMILES

CC1(C)C2CC1C(CS)CC2

InChI

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

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 Fri Dec 15 19:48:40 GMT 2023
Edited
by admin
on Fri Dec 15 19:48:40 GMT 2023
Record UNII
79T12O1XFD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
10-MERCAPTOPINANE
Systematic Name English
(±)-10-MERCAPTOPINANE
Systematic Name English
10-MERCAPTOPINANE, (±)-
Common Name English
FEMA NO. 3503, 10-MERCAPTO-
Code English
BICYCLO(3.1.1)HEPTANE-2-METHANETHIOL, 6,6-DIMETHYL-
Systematic Name English
6,6-DIMETHYLBICYCLO(3.1.1)HEPTANE-2-METHANETHIOL
Systematic Name English
10-PINANETHIOL
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
229-520-8
Created by admin on Fri Dec 15 19:48:41 GMT 2023 , Edited by admin on Fri Dec 15 19:48:41 GMT 2023
PRIMARY
CAS
6588-78-9
Created by admin on Fri Dec 15 19:48:41 GMT 2023 , Edited by admin on Fri Dec 15 19:48:41 GMT 2023
PRIMARY
FDA UNII
79T12O1XFD
Created by admin on Fri Dec 15 19:48:41 GMT 2023 , Edited by admin on Fri Dec 15 19:48:41 GMT 2023
PRIMARY
EPA CompTox
DTXSID80884320
Created by admin on Fri Dec 15 19:48:41 GMT 2023 , Edited by admin on Fri Dec 15 19:48:41 GMT 2023
PRIMARY
PUBCHEM
110909
Created by admin on Fri Dec 15 19:48:41 GMT 2023 , Edited by admin on Fri Dec 15 19:48:41 GMT 2023
PRIMARY