| SpectraBase Spectrum ID |
3px6FS7AI1M |
| Name |
(trans)-4-tert-Butyl-2-(3,5-dimethylphenylsulfanyl)-cyclohexanone |
| Alternate Name(s) |
(2R,4S)-4-(tert-butyl)-2-((3,5-dimethylphenyl)thio)cyclohexan-1-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H26OS |
| InChI |
InChI=1S/C18H26OS/c1-12-8-13(2)10-15(9-12)20-17-11-14(18(3,4)5)6-7-16(17)19/h8-10,14,17H,6-7,11H2,1-5H3/t14-,17+/m0/s1 |
| InChIKey |
HSNIOBLZDNHRBM-WMLDXEAASA-N |
| Literature Reference DOI |
10.1039/C5RA17913K |
| Molecular Weight |
290.465 g/mol |
| SMILES |
C1C([C@@](C[C@](C1)(C(C)(C)C)[H])(Sc1cc(cc(c1)C)C)[H])=O |
| SPLASH |
splash10-000f-1690000000-e262a471aa7c102ffda0 |
| Source of Spectrum |
RSA-5-96702-7c_major |
| Wiley ID |
1802723 |
