SpectraBase Spectrum ID |
8GqjBir3qHQ |
Name |
Diprafenone-M (O-desalkyl) |
CAS Registry Number |
42772-82-7 |
Classification |
Pharmaceutical drug metabolite |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
226.099379689 u |
Formula |
C15H14O2 |
InChI |
InChI=1S/C15H14O2/c16-14-9-5-4-8-13(14)15(17)11-10-12-6-2-1-3-7-12/h1-9,16H,10-11H2 |
InChIKey |
JCPGMXJLFWGRMZ-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
226.275 g/mol |
Nominal Mass |
226 u |
Quality |
890 |
Retention Index |
1692 |
SMILES |
OC=1C(C(CCC=2C=CC=CC2)=O)=CC=CC1 |
SPLASH |
splash10-00di-3950000000-dcb2f46ba2fcce02e581 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Etafenone-M (O desalkyl)
1-(2-Hydroxyphenyl)-3-phenylpropan-1-one |
Technique |
GC/MS |
Wiley ID |
DD2024_007871 |