| SpectraBase Spectrum ID |
Fxb7Cd3jOvS |
| Name |
Benoxaprofen-M (HO-) ME |
| Classification |
Antirheumatic |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
331.061135631 u |
| Formula |
C17H14ClNO4 |
| InChI |
InChI=1S/C17H14ClNO4/c1-9(17(21)22-2)11-7-13-15(14(20)8-11)23-16(19-13)10-3-5-12(18)6-4-10/h3-9,20H,1-2H3 |
| InChIKey |
MQSLGJVFDGYEIO-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
331.755 g/mol |
| SMILES |
c1cc(-c2oc3c(cc(cc3O)C(C(OC)=O)C)n2)ccc1Cl |
| SPLASH |
splash10-0089-4190000000-957d4b97ceefc7fd71d8 |
| 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_6286 |
