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5,5-Dimethyl-1,3-diphenethyl-2-thioxo-hexahydropyrimidine-4,6-quinone
SpectraBase Compound ID DGDy3EEpM0d
InChI InChI=1S/C22H24N2O2S/c1-22(2)19(25)23(15-13-17-9-5-3-6-10-17)21(27)24(20(22)26)16-14-18-11-7-4-8-12-18/h3-12H,13-16H2,1-2H3
InChIKey MPZOVFAXHHCPCS-UHFFFAOYSA-N
Mol Weight 380.51 g/mol
Molecular Formula C22H24N2O2S
Exact Mass 380.155849 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G9UMz3KgKmf
Name 5,5-Dimethyl-1,3-diphenethyl-2-thioxo-hexahydropyrimidine-4,6-quinone
CAS Registry Number 110458-08-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24N2O2S
InChI InChI=1S/C22H24N2O2S/c1-22(2)19(25)23(15-13-17-9-5-3-6-10-17)21(27)24(20(22)26)16-14-18-11-7-4-8-12-18/h3-12H,13-16H2,1-2H3
InChIKey MPZOVFAXHHCPCS-UHFFFAOYSA-N
Molecular Weight 380.506 g/mol
SMILES C1(N(C(C(C(N1CCc1ccccc1)=O)(C)C)=O)CCc1ccccc1)=S
SPLASH splash10-0udi-5900000000-b2b0b71199910a71beb8
Source of Spectrum J-52-5183-3
Synonyms 5,5-Dimethyl-1,3-bis(2-phenylethyl)-2-thioxo-hexahydropyrimidine-4,6-dione
Wiley ID 1359791