| SpectraBase Spectrum ID |
5VJMqyTeTZ2 |
| Name |
Bromadiolone |
| CAS Registry Number |
28772-56-7 |
| Classification |
Rodenticide |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
526.077972217 u |
| Formula |
C30H23BrO4 |
| InChI |
InChI=1S/C30H23BrO4/c31-23-16-14-20(15-17-23)19-10-12-22(13-11-19)26(32)18-25(21-6-2-1-3-7-21)28-29(33)24-8-4-5-9-27(24)35-30(28)34/h1-17,25-26,28,32H,18H2 |
| InChIKey |
QUNMLCCVZLKSGL-UHFFFAOYSA-N |
| Ionization Energy |
70 eV |
| Ionization Type |
Negative Chemical Ionization (NCI) |
| Molecular Weight |
527.414 g/mol |
| Nominal Mass |
526 u |
| Quality |
0 |
| SMILES |
OC(CC(C1C(C=2C(OC1=O)=CC=CC2)=O)C=1C=CC=CC1)C1=CC=C(C=2C=CC(=CC2)Br)C=C1 |
| SPLASH |
splash10-0udi-0090000000-52871e2c4ec87dd39e41 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Broprodifacoum
3-[3-[4-(4-Bromophenyl)phenyl]-3-hydroxy-1-phenyl-propyl]-2-hydroxy-chromen-4-one |
| Technique |
DI/MS |
| Wiley ID |
DD2024_000277 |
