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2-(2-Chlorophenyl)-3-(phenylthio)-4H-thiochromen-4-one
SpectraBase Compound ID DNQFPswoeau
InChI InChI=1S/C21H13ClOS2/c22-17-12-6-4-10-15(17)20-21(24-14-8-2-1-3-9-14)19(23)16-11-5-7-13-18(16)25-20/h1-13H
InChIKey WAZKPJSXKLNJKX-UHFFFAOYSA-N
Mol Weight 380.91 g/mol
Molecular Formula C21H13ClOS2
Exact Mass 380.009635 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4yzMX0t9YqI
Name 2-(2-Chlorophenyl)-3-(phenylthio)-4H-thiochromen-4-one
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 380.009635086 u
Formula C21H13ClOS2
InChI InChI=1S/C21H13ClOS2/c22-17-12-6-4-10-15(17)20-21(24-14-8-2-1-3-9-14)19(23)16-11-5-7-13-18(16)25-20/h1-13H
InChIKey WAZKPJSXKLNJKX-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS-QP2010
Ionization Type EI
Literature Reference DOI 10.1002/cctc.202201557
Molecular Weight 380.907 g/mol
Reported Formula C21H13ClOS2
SMILES C1=CC2=C(C=C1)SC(=C(C2=O)SC1=CC=CC=C1)C1=CC=CC=C1Cl
SPLASH splash10-0002-0009000000-29e6710d89a5723b62ec
Source of Spectrum CCC-15-8-3t (DOI: 10.1002/cctc.202201557)
Wiley ID 1910129