| SpectraBase Spectrum ID |
KmV6NscwkKD |
| Name |
(3as,4S,7as)-1,5-Diketo-7A-methyl-2,3,3A,4,6,7-hexahydroindene-4-carboxylic acid methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
224.104858991 u |
| Formula |
C12H16O4 |
| InChI |
InChI=1S/C12H16O4/c1-12-6-5-8(13)10(11(15)16-2)7(12)3-4-9(12)14/h7,10H,3-6H2,1-2H3/t7-,10-,12-/m0/s1 |
| InChIKey |
GUXSRJXCIKVXOU-JWYUURKGSA-N |
| Molecular Weight |
224.256 g/mol |
| SMILES |
[C@]12([C@@](C(=O)CC2)(CCC([C@]1(C(=O)OC)[H])=O)C)[H] |
