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4,4'-Bis[5-(4-methylphenyl)-.delta.2-isoxazolin-3-yl]diphenyl sulphide
SpectraBase Compound ID 5Gjo6VeL8DQ
InChI InChI=1S/C32H28N2O2S/c1-21-3-7-25(8-4-21)31-19-29(33-35-31)23-11-15-27(16-12-23)37-28-17-13-24(14-18-28)30-20-32(36-34-30)26-9-5-22(2)6-10-26/h3-18,31-32H,19-20H2,1-2H3
InChIKey HIIDZINFDHTIRQ-UHFFFAOYSA-N
Mol Weight 504.6 g/mol
Molecular Formula C32H28N2O2S
Exact Mass 504.187149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K0hgl74eAH2
Name 4,4'-Bis[5-(4-methylphenyl)-.delta.2-isoxazolin-3-yl]diphenyl sulphide
Alternate Name(s) 5-(4-Methylphenyl)-3-[4-[[4-[5-(4-methylphenyl)-4,5-dihydroisoxazol-3-yl]phenyl]thio]phenyl]-4,5-dihydroisoxazole 5-(p-tolyl)-3-[4-[4-[5-(p-tolyl)-4,5-dihydroisoxazol-3-yl]phenyl]sulfanylphenyl]-4,5-dihydroisoxazole 5-(4-Methylphenyl)-3-[4-[4-[5-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-3-yl]phenyl]sulfanylphenyl]-4,5-dihydro-1,2-oxazole
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Formula C32H28N2O2S
InChI InChI=1S/C32H28N2O2S/c1-21-3-7-25(8-4-21)31-19-29(33-35-31)23-11-15-27(16-12-23)37-28-17-13-24(14-18-28)30-20-32(36-34-30)26-9-5-22(2)6-10-26/h3-18,31-32H,19-20H2,1-2H3
InChIKey HIIDZINFDHTIRQ-UHFFFAOYSA-N
Molecular Weight 504.648 g/mol
SMILES C1(=NOC(C1)c1ccc(cc1)C)c1ccc(Sc2ccc(C3=NOC(C3)c3ccc(cc3)C)cc2)cc1
SPLASH splash10-014l-9200020000-0bcd458d32d8c73bcb4c
Source of Spectrum Y1-32-1124-8
Wiley ID 1526132