| SpectraBase Spectrum ID |
E4oApL8cpc6 |
| Name |
Benzbromarone-M -H2O AC |
| Classification |
Uricosuric |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
461.910234862 u |
| Formula |
C19H12Br2O4 |
| InChI |
InChI=1S/C19H12Br2O4/c1-3-15-17(12-6-4-5-7-16(12)25-15)18(23)11-8-13(20)19(14(21)9-11)24-10(2)22/h3-9H,1H2,2H3 |
| InChIKey |
RWTVGDRIRZWCKJ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
464.109 g/mol |
| SMILES |
c1(cc(c(c(Br)c1)OC(=O)C)Br)C(c1c(C=C)oc2ccccc12)=O |
| SPLASH |
splash10-00di-1253900000-61cd91843e2ee99de8ed |
| 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. |
| Sample Preparation Procedure |
Detected: U+UHYAC |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Synonyms |
Benzbromarone-M (HO-ethyl-) -H2O AC |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_2257 |
