| SpectraBase Spectrum ID |
LmfQNn7ZbTl |
| Name |
Benzbromarone ME |
| Classification |
Uricosuric |
| Copyright |
Copyright © 2023-2024 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 |
| SMILES |
c1(cc(c(c(Br)c1)OC)Br)C(c1c(CC)oc2ccccc12)=O |
| SPLASH |
splash10-000i-1442900000-c662bfa1a87fce908099 |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_2258 |
