| SpectraBase Spectrum ID |
7M7KnmPCwVv |
| Name |
1,3-Benzodioxole-5-propanoic acid, .alpha.-bromo-.beta.-oxo-, ethyl ester |
| Alternate Name(s) |
Ethyl 3-(1,3-benzodioxol-5-yl)-2-bromo-3-oxopropanoate
Ethyl bromo-(3,4-methylenedioxybenzoyl)acetate |
| CAS Registry Number |
81581-28-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H11BrO5 |
| InChI |
InChI=1S/C12H11BrO5/c1-2-16-12(15)10(13)11(14)7-3-4-8-9(5-7)18-6-17-8/h3-5,10H,2,6H2,1H3 |
| InChIKey |
PBSJIUQYMFMXHC-UHFFFAOYSA-N |
| Molecular Weight |
315.119 g/mol |
| SMILES |
C(C(c1cc2OCOc2cc1)=O)(C(=O)OCC)Br |
| SPLASH |
splash10-0002-0900000000-ac71742b92e7c5592612 |
| Source of Spectrum |
KC-1982-188-0 |
| Wiley ID |
1314625 |
