SpectraBase Spectrum ID |
DYq2qVpwAMp |
Name |
Sulindac |
CAS Registry Number |
38194-50-2 |
Classification |
Analgesic |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
356.088243741 u |
Formula |
C20H17FO3S |
InChI |
InChI=1S/C20H17FO3S/c1-12-17(9-13-3-6-15(7-4-13)25(2)24)16-8-5-14(21)10-19(16)18(12)11-20(22)23/h3-10H,11H2,1-2H3,(H,22,23)/b17-9+ |
InChIKey |
MLKXDPUZXIRXEP-RQZCQDPDSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
356.411 g/mol |
SMILES |
C=1(C)\C(=C/c2ccc(cc2)S(C)=O)c2c(cc(cc2)F)C1CC(=O)O |
SPLASH |
splash10-0002-1391000000-3c7821058277bba9f75a |
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_1527 |