| SpectraBase Spectrum ID |
5rqeAoBW1QR |
| Name |
Diflunisal |
| CAS Registry Number |
22494-42-4 |
| Classification |
Analgesic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
250.044150441 u |
| Formula |
C13H8F2O3 |
| InChI |
InChI=1S/C13H8F2O3/c14-8-2-3-9(11(15)6-8)7-1-4-12(16)10(5-7)13(17)18/h1-6,16H,(H,17,18) |
| InChIKey |
HUPFGZXOMWLGNK-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
250.201 g/mol |
| SMILES |
c1(ccc(-c2ccc(c(c2)C(O)=O)O)c(c1)F)F |
| SPLASH |
splash10-0ugi-3790000000-4286f2314ce50aa9164e |
| 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. |
| 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_1478 |
