| SpectraBase Spectrum ID |
EvwAnLzkIMb |
| Name |
2-acetyl-2-(phenylthio)-1-cyclohexanone |
| Alternate Name(s) |
2-acetyl-2-(phenylthio)cyclohexanone
2-acetyl-2-phenylsulfanylcyclohexan-1-one
2-ethanoyl-2-phenylsulfanyl-cyclohexan-1-one |
| CAS Registry Number |
98711-81-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H16O2S |
| InChI |
InChI=1S/C14H16O2S/c1-11(15)14(10-6-5-9-13(14)16)17-12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-10H2,1H3 |
| InChIKey |
FLWFGYZMQJCFNY-UHFFFAOYSA-N |
| Molecular Weight |
248.340 g/mol |
| SMILES |
C1(Sc2ccccc2)(C(=O)CCCC1)C(=O)C |
| SPLASH |
splash10-0a4i-0090000000-3bb7ce97eddc72f50f43 |
| Source of Spectrum |
KC-1985-1242-45 |
| Wiley ID |
1251012 |
