| SpectraBase Spectrum ID |
9HBUOTSQ27j |
| Name |
Cyclohexanone, 2-[5-(methylthio)-3-oxopentyl]- |
| Alternate Name(s) |
2-(5-Methylthio-3-oxopentyl)cyclohexanone
2-[5-(methylsulfanyl)-3-oxopentyl]cyclohexanone |
| CAS Registry Number |
80727-35-1 |
| Comments |
Removed - expert review: contamination (chloroform)) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H20O2S |
| InChI |
InChI=1S/C12H20O2S/c1-15-9-8-11(13)7-6-10-4-2-3-5-12(10)14/h10H,2-9H2,1H3 |
| InChIKey |
JRSXLVZAAGPUGV-UHFFFAOYSA-N |
| Molecular Weight |
228.350 g/mol |
| SMILES |
C1(=O)C(CCC(=O)CCSC)CCCC1 |
| SPLASH |
splash10-001r-9000000000-13ee8a35e244862a4dd4 |
| Source of Spectrum |
H-64-2027-0 |
| Wiley ID |
1229475 |
![Cyclohexanone, 2-[5-(methylthio)-3-oxopentyl]-](/api/spectrum/9HBUOTSQ27j/structure.png?h=300&w=458 "Cyclohexanone, 2-[5-(methylthio)-3-oxopentyl]-")
