| SpectraBase Spectrum ID |
9LJ3lv5TDmO |
| Name |
Cyclohexanone, 3-(1,1-dimethylethyl)-5-(ethylthio)-, (3S-trans)- |
| CAS Registry Number |
97551-93-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H22OS |
| InChI |
InChI=1S/C12H22OS/c1-5-14-11-7-9(12(2,3)4)6-10(13)8-11/h9,11H,5-8H2,1-4H3/t9-,11+/m0/s1 |
| InChIKey |
UKMFAOPXAVDYEY-GXSJLCMTSA-N |
| Molecular Weight |
214.367 g/mol |
| SMILES |
[C@@]1(C(C)(C)C)(CC(=O)C[C@@](C1)(SCC)[H])[H] |
| SPLASH |
splash10-0a4j-9100000000-244d8e8160d4cca2e2a6 |
| Source of Spectrum |
J-50-4181-25 |
| Synonyms |
(3S,5R)-3-tert-butyl-5-(ethylsulfanyl)cyclohexanone |
| Wiley ID |
1213578 |
