| SpectraBase Spectrum ID |
4B3kCCURLk |
| Name |
(3aR,7S,7aS)-7a-(methylthio)-7-phenyl-3,3a,4,5,6,7-hexahydroisobenzofuran-1-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H18O2S |
| InChI |
InChI=1S/C15H18O2S/c1-18-15-12(10-17-14(15)16)8-5-9-13(15)11-6-3-2-4-7-11/h2-4,6-7,12-13H,5,8-10H2,1H3/t12-,13+,15-/m1/s1 |
| InChIKey |
CWPVRBKITSUBTJ-VNHYZAJKSA-N |
| Molecular Weight |
262.367 g/mol |
| SMILES |
[C@]12(C(OC[C@]2(CCC[C@]1(c1ccccc1)[H])[H])=O)SC |
| SPLASH |
splash10-02tc-4790000000-7add76fc030651af5ce0 |
| Source of Spectrum |
KC-0-1679-39 |
| Synonyms |
(3aR,7S,7aS)-7a-methylsulfanyl-7-phenyl-3,3a,4,5,6,7-hexahydro-2-benzofuran-1-one
(3aR,7S,7aS)-7a-methylsulfanyl-7-phenyl-3,3a,4,5,6,7-hexahydroisobenzofuran-1-one |
| Wiley ID |
822706 |
