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2-(4-Ethylphenyl)-3-(4-tolylthio)-4H-thiochromen-4-one
SpectraBase Compound ID 4d1kR8Z9vYU
InChI InChI=1S/C24H20OS2/c1-3-17-10-12-18(13-11-17)23-24(26-19-14-8-16(2)9-15-19)22(25)20-6-4-5-7-21(20)27-23/h4-15H,3H2,1-2H3
InChIKey LTQFKAWMRPAMTH-UHFFFAOYSA-N
Mol Weight 388.54 g/mol
Molecular Formula C24H20OS2
Exact Mass 388.095558 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B02EuFz9BLM
Name 2-(4-Ethylphenyl)-3-(4-tolylthio)-4H-thiochromen-4-one
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H20OS2
InChI InChI=1S/C24H20OS2/c1-3-17-10-12-18(13-11-17)23-24(26-19-14-8-16(2)9-15-19)22(25)20-6-4-5-7-21(20)27-23/h4-15H,3H2,1-2H3
InChIKey LTQFKAWMRPAMTH-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS-QP2010
Ionization Type EI
Literature Reference DOI 10.1002/cctc.202201557
Molecular Weight 388.543 g/mol
Reported Formula C24H20OS2
SMILES C1=CC2=C(C=C1)SC(=C(C2=O)SC1=CC=C(C=C1)C)C1=CC=C(C=C1)CC
SPLASH splash10-0a4i-0009000000-a9ce21a2023201a35713
Source of Spectrum CCC-15-8-3n (DOI: 10.1002/cctc.202201557)
Wiley ID 1910123