| SpectraBase Spectrum ID |
JEl78Sk91cm |
| Name |
Coumachlor |
| CAS Registry Number |
81-82-3 |
| Classification |
Rodenticide |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
342.065886659 u |
| Formula |
C19H15ClO4 |
| InChI |
InChI=1S/C19H15ClO4/c1-11(21)10-15(12-6-8-13(20)9-7-12)17-18(22)14-4-2-3-5-16(14)24-19(17)23/h2-9,15,22H,10H2,1H3 |
| InChIKey |
DEKWZWCFHUABHE-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
342.778 g/mol |
| Nominal Mass |
342 u |
| Quality |
932 |
| Retention Index |
2505 |
| SMILES |
OC1=C(C(C2=CC=C(C=C2)Cl)CC(=O)C)C(OC=2C1=CC=CC2)=O |
| SPLASH |
splash10-0002-2974000000-5182234860b3535df400 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3-[1-(4-Chlorophenyl)-3-oxo-butyl]-2-hydroxy-chromen-4-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000808 |
