| SpectraBase Spectrum ID |
LAzugDbMlFJ |
| Name |
(+-)-(3S,3aS,7aR)-3-Methyl-1,3,3a,6,7,7a-hexahydroisobenzofuran-1-one |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H12O2 |
| InChI |
InChI=1S/C9H12O2/c1-6-7-4-2-3-5-8(7)9(10)11-6/h2,4,6-8H,3,5H2,1H3/t6-,7+,8+/m0/s1 |
| InChIKey |
PSPYYERSVRDCAQ-XLPZGREQSA-N |
| Molecular Weight |
152.193 g/mol |
| SMILES |
C1(O[C@]([C@]2(C=CCC[C@@]12[H])[H])(C)[H])=O |
| SPLASH |
splash10-001i-9500000000-eb13ab5086fad4d36d3f |
| Source of Spectrum |
QE-8-748-22 |
| Synonyms |
(3S,3aS,7aR)-3-methyl-3a,6,7,7a-tetrahydro-2-benzofuran-1(3H)-one |
| Wiley ID |
1557179 |
