| SpectraBase Spectrum ID |
gxDdO7E2a |
| Name |
Ketoprofen-M (HO-) isomer-2 2ME |
| Classification |
Antirheumatic |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
298.120509056 u |
| Formula |
C18H18O4 |
| InChI |
InChI=1S/C18H18O4/c1-12(18(20)22-3)13-6-4-7-14(10-13)17(19)15-8-5-9-16(11-15)21-2/h4-12H,1-3H3 |
| InChIKey |
RSKJLVJQVNOJIJ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
298.338 g/mol |
| SMILES |
C(c1cc(C(C(=O)OC)C)ccc1)(c1cc(OC)ccc1)=O |
| SPLASH |
splash10-000j-3980000000-82ec523a19799b36d3fc |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Sample Preparation Procedure |
Detected: UME |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_5214 |
