SpectraBase Spectrum ID |
HQ6thJHMbAg |
Name |
(Z)-2-(5-Fluoro-2-methyl-1-(4-(methylthio)benzylidene)-1H-inden-3-yl)acetic acid, tms |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
412.132855915 u |
Formula |
C23H25FO2SSi |
InChI |
InChI=1S/C23H25FO2SSi/c1-15-20(12-16-6-9-18(27-2)10-7-16)19-11-8-17(24)13-22(19)21(15)14-23(25)26-28(3,4)5/h6-13H,14H2,1-5H3/b20-12- |
InChIKey |
KLZXVORSBLICDC-NDENLUEZSA-N |
Molecular Weight |
412.594 g/mol |
SMILES |
C=1(\C(=C\C2=CC=C(SC)C=C2)C=2C(C1CC(O[Si](C)(C)C)=O)=CC(=CC2)F)C |