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1,3-bis(3-(trifluoromethyl)phenyl)-9H-thioxanthen-9-one

View entire compound with spectra: 1 MS (GC)

1,3-bis(3-(trifluoromethyl)phenyl)-9H-thioxanthen-9-one
SpectraBase Compound ID Kijyoh9Z5Kj
InChI InChI=1S/C27H14F6OS/c28-26(29,30)18-7-3-5-15(11-18)17-13-21(16-6-4-8-19(12-16)27(31,32)33)24-23(14-17)35-22-10-2-1-9-20(22)25(24)34/h1-14H
InChIKey PPLRPTKIWZQTQD-UHFFFAOYSA-N
Mol Weight 500.46 g/mol
Molecular Formula C27H14F6OS
Exact Mass 500.066955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 39JtxdDhe4Z
Name 1,3-bis(3-(trifluoromethyl)phenyl)-9H-thioxanthen-9-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H14F6OS
InChI InChI=1S/C27H14F6OS/c28-26(29,30)18-7-3-5-15(11-18)17-13-21(16-6-4-8-19(12-16)27(31,32)33)24-23(14-17)35-22-10-2-1-9-20(22)25(24)34/h1-14H
InChIKey PPLRPTKIWZQTQD-UHFFFAOYSA-N
Molecular Weight 500.458 g/mol
SMILES c12C(c3ccccc3Sc2cc(-c2cc(C(F)(F)F)ccc2)cc1-c1cc(C(F)(F)F)ccc1)=O
SPLASH splash10-0002-0011950000-c92aed47129acbf472af
Source of Spectrum F-68-715-4g
Wiley ID 1707503