| SpectraBase Spectrum ID |
8FW4JVZgTIc |
| Name |
1,3-Isobenzofurandione, 3a,4,7,7a-tetrahydro-4-methyl-7-(phenylthio)-, (3a.alpha.,4.beta.,7.beta.,7a.alpha.)- |
| CAS Registry Number |
113108-30-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H14O3S |
| InChI |
InChI=1S/C15H14O3S/c1-9-7-8-11(19-10-5-3-2-4-6-10)13-12(9)14(16)18-15(13)17/h2-9,11-13H,1H3/t9-,11+,12-,13+/m0/s1 |
| InChIKey |
BVIHWIIAGMEFKA-ZBAXXZLZSA-N |
| Molecular Weight |
274.334 g/mol |
| SMILES |
C1(OC(=O)[C@@]2([C@]1([C@@](C=C[C@@]2(C)[H])(Sc1ccccc1)[H])[H])[H])=O |
| SPLASH |
splash10-03dl-7920000000-7093ae2fb42e0b88a5ee |
| Source of Spectrum |
KC-1987-975-75 |
| Synonyms |
(3aS,4S,7R,7aR)-4-methyl-7-(phenylsulfanyl)-3a,4,7,7a-tetrahydro-2-benzofuran-1,3-dione
6-Methyl-3-phenylthiocyclohex-4-ene-1,2-dicarboxylic anhydride |
| Wiley ID |
1278014 |
