| SpectraBase Spectrum ID |
CqEGn3SZth4 |
| Name |
(3aS,4S,6S,7S,7aS)-7-Hydroxy-6-iodo-6-methyl-3-oxo-octahydro-benzofuran-4-carboxylic acid methyl ester |
| Alternate Name(s) |
Methyl octahydro-6-methyl-6-iodo-7-hydroxy-3-oxobenzofuran-4-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H15IO5 |
| InChI |
InChI=1S/C11H15IO5/c1-11(12)3-5(10(15)16-2)7-6(13)4-17-8(7)9(11)14/h5,7-9,14H,3-4H2,1-2H3/t5-,7+,8-,9-,11-/m0/s1 |
| InChIKey |
OJSIRSSTTKLQCU-KHWWSFOCSA-N |
| Molecular Weight |
354.140 g/mol |
| SMILES |
O[C@]1([C@@]2([C@]([C@@](C(=O)OC)(C[C@@]1(I)C)[H])(C(=O)CO2)[H])[H])[H] |
| SPLASH |
splash10-0kdi-0193000000-1a1009961f18742f5d90 |
| Source of Spectrum |
C-117-1925-23 |
| Wiley ID |
1697543 |
