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3-(4-Chlorobenzoyl)-1,4,6-triphenyl-2(1H)-pyridinethione
SpectraBase Compound ID KkSFjNE2UYj
InChI InChI=1S/C30H20ClNOS/c31-24-18-16-23(17-19-24)29(33)28-26(21-10-4-1-5-11-21)20-27(22-12-6-2-7-13-22)32(30(28)34)25-14-8-3-9-15-25/h1-20H
InChIKey ZXUXAPABOJDGQP-UHFFFAOYSA-N
Mol Weight 478.01 g/mol
Molecular Formula C30H20ClNOS
Exact Mass 477.095413 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 44rRXGDSiC2
Name 3-(4-Chlorobenzoyl)-1,4,6-triphenyl-2(1H)-pyridinethione
Alternate Name(s) (4-chlorophenyl)(1,4,6-triphenyl-2-thioxo-1,2-dihydro-3-pyridinyl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H20ClNOS
InChI InChI=1S/C30H20ClNOS/c31-24-18-16-23(17-19-24)29(33)28-26(21-10-4-1-5-11-21)20-27(22-12-6-2-7-13-22)32(30(28)34)25-14-8-3-9-15-25/h1-20H
InChIKey ZXUXAPABOJDGQP-UHFFFAOYSA-N
Molecular Weight 478.009 g/mol
SMILES C1(C(=C(C=C(N1c1ccccc1)c1ccccc1)c1ccccc1)C(c1ccc(cc1)Cl)=O)=S
SPLASH splash10-002b-0000900000-ea1e7a83939759df06a2
Source of Spectrum SO-0-956-9
Wiley ID 1539018