| SpectraBase Spectrum ID |
JGrhGHZYgaW |
| Name |
Diclofenac-A (-H2O) ME |
| Classification |
Pharmaceutical drug artifact derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
291.021769377 u |
| Formula |
C15H11Cl2NO |
| InChI |
InChI=1S/C15H11Cl2NO/c16-12-5-3-6-13(17)15(12)18-9-11(19)8-10-4-1-2-7-14(10)18/h1-7H,8-9H2 |
| InChIKey |
CDZBMDMQRHZYFN-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
292.165 g/mol |
| Nominal Mass |
291 u |
| Quality |
920 |
| Retention Index |
2164 |
| SMILES |
C1(N2C3=C(CC(C2)=O)C=CC=C3)=C(C=CC=C1Cl)Cl |
| SPLASH |
splash10-004i-2290000000-9411375fa9a3c6421460 |
| Sample Comments |
Structure uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-(2,6-dichlorophenyl)-1,4-dihydroquinolin-3(2H)-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000896 |
