SpectraBase Spectrum ID |
519KzkbaZRr |
Name |
Sulindac methyl artifact |
Copyright |
Copyright © 2012-2024 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. All Rights Reserved. |
Formula |
C21H19FO3S |
InChI |
InChI=1S/C21H19FO3S/c1-13-18(10-14-4-7-16(8-5-14)26(3)24)17-9-6-15(22)11-20(17)19(13)12-21(23)25-2/h4-11H,12H2,1-3H3/b18-10- |
InChIKey |
QQHHBCZJIQNNSG-ZDLGFXPLSA-N |
SMILES |
c12ccc(cc1C(=C(\C2=C/c1ccc(cc1)S(C)=O)C)CC(OC)=O)F |
SPLASH |
splash10-001j-0193000000-2d233ab6a4ef1921d0f4 |
Source of Spectrum |
Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences |