| SpectraBase Spectrum ID |
JIWkUXycWAa |
| Name |
Ketoprofen-M (OH) 2ME II |
| Classification |
Pharmaceutical drug derivative |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
298.120509056 u |
| Formula |
C18H18O4 |
| InChI |
InChI=1S/C18H18O4/c1-12(18(20)22-3)14-9-15(11-16(10-14)21-2)17(19)13-7-5-4-6-8-13/h4-12H,1-3H3 |
| InChIKey |
ULKYZCNYWKRERJ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
298.338 g/mol |
| Nominal Mass |
298 u |
| Quality |
906 |
| Retention Index |
2198 |
| SMILES |
C=1(C(C2=CC=CC=C2)=O)C=C(C(C(OC)=O)C)C=C(C1)OC |
| SPLASH |
splash10-000i-3950000000-200ca337bd7344120792 |
| Sample Comments |
Structure uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
methyl 2-(3-benzoyl-5-methoxyphenyl)propanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_005307 |
