| SpectraBase Spectrum ID |
JHQYkNvyQHg |
| Name |
Coumachlor ME |
| Classification |
Rodenticide derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
356.081536723 u |
| Formula |
C20H17ClO4 |
| InChI |
InChI=1S/C20H17ClO4/c1-12(22)11-16(13-7-9-14(21)10-8-13)18-19(24-2)15-5-3-4-6-17(15)25-20(18)23/h3-10,16H,11H2,1-2H3 |
| InChIKey |
CBGNTUSYXDOUAM-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
356.805 g/mol |
| Nominal Mass |
356 u |
| Quality |
930 |
| Retention Index |
2606 |
| SMILES |
C1(=C(C=2C(OC1=O)=CC=CC2)OC)C(C=1C=CC(=CC1)Cl)CC(=O)C |
| SPLASH |
splash10-03di-1879000000-a71596b2cdc7b8b915ee |
| Sample Comments |
Structure uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3-(1-(4-chlorophenyl)-3-oxobutyl)-4-methoxy-2H-chromen-2-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000812 |
