| SpectraBase Spectrum ID |
4N16FCFpxvt |
| Name |
trans-3-methyl-4-oxo-2-(phenylthio)-2,3,4,5,6,7-hexahydrobenzofuran |
| CAS Registry Number |
113893-91-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H16O2S |
| InChI |
InChI=1S/C15H16O2S/c1-10-14-12(16)8-5-9-13(14)17-15(10)18-11-6-3-2-4-7-11/h2-4,6-7,10,15H,5,8-9H2,1H3/t10-,15+/m0/s1 |
| InChIKey |
NDUDKGFPFRFETE-ZUZCIYMTSA-N |
| Molecular Weight |
260.351 g/mol |
| SMILES |
C12=C(O[C@@]([C@]2(C)[H])(Sc2ccccc2)[H])CCCC1=O |
| SPLASH |
splash10-0udi-1900000000-f49725102dd13488f7c7 |
| Source of Spectrum |
J-53-2530-10 |
| Synonyms |
(2R,3S)-3-methyl-2-(phenylsulfanyl)-3,5,6,7-tetrahydro-1-benzofuran-4(2H)-one |
| Wiley ID |
1263726 |
