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3-(4-Ethylphenyl)-1-(2-methoxyphenyl)-9H-thioxanthen-9-one

View entire compound with spectra: 1 MS (GC)

3-(4-Ethylphenyl)-1-(2-methoxyphenyl)-9H-thioxanthen-9-one
SpectraBase Compound ID jUHFMBKNfz
InChI InChI=1S/C28H22O2S/c1-3-18-12-14-19(15-13-18)20-16-23(21-8-4-6-10-24(21)30-2)27-26(17-20)31-25-11-7-5-9-22(25)28(27)29/h4-17H,3H2,1-2H3
InChIKey HTODAUPVOBBKKQ-UHFFFAOYSA-N
Mol Weight 422.54 g/mol
Molecular Formula C28H22O2S
Exact Mass 422.134051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D9VGwZKmxbe
Name 3-(4-Ethylphenyl)-1-(2-methoxyphenyl)-9H-thioxanthen-9-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H22O2S
InChI InChI=1S/C28H22O2S/c1-3-18-12-14-19(15-13-18)20-16-23(21-8-4-6-10-24(21)30-2)27-26(17-20)31-25-11-7-5-9-22(25)28(27)29/h4-17H,3H2,1-2H3
InChIKey HTODAUPVOBBKKQ-UHFFFAOYSA-N
Molecular Weight 422.542 g/mol
SMILES c12C(c3ccccc3Sc2cc(-c2ccc(cc2)CC)cc1-c1c(OC)cccc1)=O
SPLASH splash10-0006-0009000000-2ff4a14eec4414e7de0d
Source of Spectrum F-68-717-6a
Wiley ID 1707495