| SpectraBase Spectrum ID |
2n7p8JP812G |
| Name |
Benzbromarone ME |
| Classification |
Uricosuric |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
435.930970308 u |
| Formula |
C18H14Br2O3 |
| InChI |
InChI=1S/C18H14Br2O3/c1-3-14-16(11-6-4-5-7-15(11)23-14)17(21)10-8-12(19)18(22-2)13(20)9-10/h4-9H,3H2,1-2H3 |
| InChIKey |
BFNPMHRTUYWBIA-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
438.115 g/mol |
| Nominal Mass |
436 u |
| Quality |
905 |
| Retention Index |
2723 |
| SMILES |
C=1(C2=C(OC1CC)C=CC=C2)C(C1=CC(=C(C(=C1)Br)OC)Br)=O |
| SPLASH |
splash10-004r-2961100000-4b20dbd54154b38f7c80 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(3,5-dibromo-4-methoxyphenyl)(2-ethyl-1-benzofuran-3-yl)methanone |
| Technique |
GC/MS |
| Wiley ID |
DD2024_006522 |
