| SpectraBase Spectrum ID |
9TrtQp0xlwg |
| Name |
(3R*,4R*)-3,4-dimethyl-1-((4-methylphenyl)sulfonyl)-5-hexen-2-one |
| CAS Registry Number |
87040-01-5 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H20O3S |
| InChI |
InChI=1S/C15H20O3S/c1-5-12(3)13(4)15(16)10-19(17,18)14-8-6-11(2)7-9-14/h5-9,12-13H,1,10H2,2-4H3/t12-,13-/m1/s1 |
| InChIKey |
YDENPVLNUAJOQU-CHWSQXEVSA-N |
| Molecular Weight |
280.382 g/mol |
| SMILES |
C(S(c1ccc(cc1)C)(=O)=O)C([C@@]([C@@](C=C)(C)[H])(C)[H])=O |
| SPLASH |
splash10-0a4l-9500000000-ea48f8531d4a539a61a8 |
| Source of Spectrum |
C-111-8890-3 |
| Synonyms |
(3R,4R)-3,4-dimethyl-1-[(4-methylphenyl)sulfonyl]-5-hexen-2-one |
| Wiley ID |
1283761 |
