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Ethanone, 2-(hexahydro-4,6-diphenyl-2-thioxo-4-pyrimidinyl)-1-phenyl-
SpectraBase Compound ID 2Bk9OCp3ZQ3
InChI InChI=1S/C24H22N2OS/c27-22(19-12-6-2-7-13-19)17-24(20-14-8-3-9-15-20)16-21(25-23(28)26-24)18-10-4-1-5-11-18/h1-15,21H,16-17H2,(H2,25,26,28)
InChIKey VVQBJLRPIWOKNH-UHFFFAOYSA-N
Mol Weight 386.51 g/mol
Molecular Formula C24H22N2OS
Exact Mass 386.145285 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ApfHGcKsMj1
Name Ethanone, 2-(hexahydro-4,6-diphenyl-2-thioxo-4-pyrimidinyl)-1-phenyl-
CAS Registry Number 98929-04-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22N2OS
InChI InChI=1S/C24H22N2OS/c27-22(19-12-6-2-7-13-19)17-24(20-14-8-3-9-15-20)16-21(25-23(28)26-24)18-10-4-1-5-11-18/h1-15,21H,16-17H2,(H2,25,26,28)
InChIKey VVQBJLRPIWOKNH-UHFFFAOYSA-N
Molecular Weight 386.513 g/mol
SMILES N1C(CC(NC1=S)c1ccccc1)(CC(=O)c1ccccc1)c1ccccc1
SPLASH splash10-05p2-2933000000-22f3f865f928766caa7f
Source of Spectrum AH-116-399-141
Synonyms 2-(4,6-Diphenyl-2-thioxo-hexahydro-4-pyrimidinyl)acetophenone 2-(4,6-diphenyl-2-thioxohexahydro-4-pyrimidinyl)-1-phenylethanone
Wiley ID 1362833