For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-(4-methoxyphenyl)-3-(o-tolyl)-9H-thioxanthen-9-one
SpectraBase Compound ID 2CHdgCp3cbR
InChI InChI=1S/C27H20O2S/c1-17-7-3-4-8-21(17)19-15-23(18-11-13-20(29-2)14-12-18)26-25(16-19)30-24-10-6-5-9-22(24)27(26)28/h3-16H,1-2H3
InChIKey GOMVQDDIUICVEN-UHFFFAOYSA-N
Mol Weight 408.52 g/mol
Molecular Formula C27H20O2S
Exact Mass 408.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID AlDhG7T0WNi
Name 1-(4-methoxyphenyl)-3-(o-tolyl)-9H-thioxanthen-9-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H20O2S
InChI InChI=1S/C27H20O2S/c1-17-7-3-4-8-21(17)19-15-23(18-11-13-20(29-2)14-12-18)26-25(16-19)30-24-10-6-5-9-22(24)27(26)28/h3-16H,1-2H3
InChIKey GOMVQDDIUICVEN-UHFFFAOYSA-N
Molecular Weight 408.515 g/mol
SMILES c12C(c3ccccc3Sc2cc(-c2c(C)cccc2)cc1-c1ccc(cc1)OC)=O
SPLASH splash10-0a4i-0000900000-7ee97af23c9cb877afb5
Source of Spectrum F-68-717-6d
Wiley ID 1707492