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1,4-bis(4-(ethyl)phenyl)-9H-thioxanthen-9-one
SpectraBase Compound ID 3zpG4JxLWWp
InChI InChI=1S/C29H24OS/c1-3-19-9-13-21(14-10-19)23-17-18-24(22-15-11-20(4-2)12-16-22)29-27(23)28(30)25-7-5-6-8-26(25)31-29/h5-18H,3-4H2,1-2H3
InChIKey WNLPQYSFKGEFKD-UHFFFAOYSA-N
Mol Weight 420.57 g/mol
Molecular Formula C29H24OS
Exact Mass 420.154787 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JbcVqZQdXq8
Name 1,4-bis(4-(ethyl)phenyl)-9H-thioxanthen-9-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H24OS
InChI InChI=1S/C29H24OS/c1-3-19-9-13-21(14-10-19)23-17-18-24(22-15-11-20(4-2)12-16-22)29-27(23)28(30)25-7-5-6-8-26(25)31-29/h5-18H,3-4H2,1-2H3
InChIKey WNLPQYSFKGEFKD-UHFFFAOYSA-N
Molecular Weight 420.570 g/mol
SMILES c12c(Sc3c(C2=O)cccc3)c(-c2ccc(cc2)CC)ccc1-c1ccc(cc1)CC
SPLASH splash10-01b9-0000900000-3b5f2515cdccdf0ab97c
Source of Spectrum F-68-718-9a
Wiley ID 1707490