| SpectraBase Spectrum ID |
KGOc87ZgJDF |
| Name |
[1,1'-Bicyclohexyl]-4-carboxylic acid, 4-(methylthio)-4'-oxo- |
| CAS Registry Number |
62912-30-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H22O3S |
| InChI |
InChI=1S/C14H22O3S/c1-18-14(13(16)17)8-6-11(7-9-14)10-2-4-12(15)5-3-10/h10-11H,2-9H2,1H3,(H,16,17) |
| InChIKey |
DIWCYZNBOPCJND-UHFFFAOYSA-N |
| Molecular Weight |
270.387 g/mol |
| SMILES |
OC(C1(CCC(CC1)C1CCC(CC1)=O)SC)=O |
| SPLASH |
splash10-0a59-8950000000-a297b6421f5c5f1d58e0 |
| Source of Spectrum |
C-99-3108-0 |
| Synonyms |
1-(methylsulfanyl)-4-(4-oxocyclohexyl)cyclohexane-1-carboxylic acid
4-(4'-Carboxy-4'-methylthiocyclohexyl)cyclohexanone |
| Wiley ID |
1274004 |
![[1,1'-Bicyclohexyl]-4-carboxylic acid, 4-(methylthio)-4'-oxo-](/api/spectrum/KGOc87ZgJDF/structure.png?h=300&w=458 "[1,1'-Bicyclohexyl]-4-carboxylic acid, 4-(methylthio)-4'-oxo-")
