| SpectraBase Spectrum ID |
1H5ghj4JBv8 |
| Name |
5-Bromo-3-{(ethoxycarbonyl)methyl}-7-methylphthalide |
| Alternate Name(s) |
Ethyl 2-(6-bromo-4-methyl-3-oxo-1,3-dihydroisobenzofuran-1-yl)acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H13BrO4 |
| InChI |
InChI=1S/C13H13BrO4/c1-3-17-11(15)6-10-9-5-8(14)4-7(2)12(9)13(16)18-10/h4-5,10H,3,6H2,1-2H3 |
| InChIKey |
FLCAMZOFCLEWAO-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1021/ol201563r |
| Molecular Weight |
313.147 g/mol |
| SMILES |
c1(cc(cc2c1C(OC2CC(=O)OCC)=O)Br)C |
| SPLASH |
splash10-01rf-2292000000-e8e317b0e1aa161f4890 |
| Source of Spectrum |
A1-13-4153/SMS10-3ha |
| Wiley ID |
1753578 |
