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6-(diphenylsulfuranylideneamino)-1,3-diisopropyl-5-[(E)-4,4,4-trifluoro-3-keto-but-1-enyl]pyrimidine-2,4-quinone
SpectraBase Compound ID 59Seip16Jpa
InChI InChI=1S/C26H26F3N3O3S/c1-17(2)31-23(30-36(19-11-7-5-8-12-19)20-13-9-6-10-14-20)21(15-16-22(33)26(27,28)29)24(34)32(18(3)4)25(31)35/h5-18H,1-4H3/b16-15+
InChIKey UQKSQOFQANZIJS-FOCLMDBBSA-N
Mol Weight 517.57 g/mol
Molecular Formula C26H26F3N3O3S
Exact Mass 517.164697 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CjUhzYziFdr
Name 6-(diphenylsulfuranylideneamino)-1,3-diisopropyl-5-[(E)-4,4,4-trifluoro-3-keto-but-1-enyl]pyrimidine-2,4-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H26F3N3O3S
InChI InChI=1S/C26H26F3N3O3S/c1-17(2)31-23(30-36(19-11-7-5-8-12-19)20-13-9-6-10-14-20)21(15-16-22(33)26(27,28)29)24(34)32(18(3)4)25(31)35/h5-18H,1-4H3/b16-15+
InChIKey UQKSQOFQANZIJS-FOCLMDBBSA-N
Molecular Weight 517.567 g/mol
SMILES C=1(N(C(=O)N(C(C1\C=C\C(C(F)(F)F)=O)=O)C(C)C)C(C)C)N=S(c1ccccc1)c1ccccc1
SPLASH splash10-000i-0920000000-bcf7ec227b48b1d99d30
Source of Spectrum Y1-46-5553-3
Synonyms 6-[(diphenyl-$l^{4}-sulfanylidene)amino]-1,3-di(propan-2-yl)-5-[(E)-4,4,4-trifluoro-3-oxobut-1-enyl]pyrimidine-2,4-dione 6-[(diphenyl-$l^{4}-sulfanylidene)amino]-1,3-diisopropyl-5-[(E)-4,4,4-trifluoro-3-oxo-but-1-enyl]pyrimidine-2,4-dione
Wiley ID 1622581