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5-[4-[2-(4-Tert-butylphenoxy)ethoxy]-3-ethoxy-benzylidene]-2-thioxo-hexahydropyrimidine-4,6-quinone
SpectraBase Compound ID 8ohFltIUYXn
InChI InChI=1S/C25H28N2O5S/c1-5-30-21-15-16(14-19-22(28)26-24(33)27-23(19)29)6-11-20(21)32-13-12-31-18-9-7-17(8-10-18)25(2,3)4/h6-11,14-15H,5,12-13H2,1-4H3,(H2,26,27,28,29,33)
InChIKey TYYQBQORXHTXGM-UHFFFAOYSA-N
Mol Weight 468.57 g/mol
Molecular Formula C25H28N2O5S
Exact Mass 468.171893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2mVxItsg5yh
Name 5-[4-[2-(4-tert-butylphenoxy)ethoxy]-3-ethoxy-benzylidene]-2-thioxo-hexahydropyrimidine-4,6-quinone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H28N2O5S
InChI InChI=1S/C25H28N2O5S/c1-5-30-21-15-16(14-19-22(28)26-24(33)27-23(19)29)6-11-20(21)32-13-12-31-18-9-7-17(8-10-18)25(2,3)4/h6-11,14-15H,5,12-13H2,1-4H3,(H2,26,27,28,29,33)
InChIKey TYYQBQORXHTXGM-UHFFFAOYSA-N
Molecular Weight 468.568 g/mol
SMILES N1C(NC(C(C1=O)=Cc1cc(OCC)c(cc1)OCCOc1ccc(C(C)(C)C)cc1)=O)=S
SPLASH splash10-052f-9800000000-c5167ef8c2f048aba2c6
Synonyms 5-[[4-[2-(4-tert-butylphenoxy)ethoxy]-3-ethoxy-phenyl]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione 5-[[4-[2-(4-tert-butylphenoxy)ethoxy]-3-ethoxy-phenyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Wiley ID 1448234