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4-[(p-Cyanobenzoyl)oxy]-4-(p-cyanophenyl)-1,1,3-triphenyl-2-azabuta-1,3-diene
SpectraBase Compound ID IcZdUekYwIL
InChI InChI=1S/C36H23N3O2/c37-24-26-16-20-31(21-17-26)35(41-36(40)32-22-18-27(25-38)19-23-32)34(30-14-8-3-9-15-30)39-33(28-10-4-1-5-11-28)29-12-6-2-7-13-29/h1-23H/b35-34+
InChIKey KZPHBJXNGMODDR-XAHDOWKMSA-N
Mol Weight 529.6 g/mol
Molecular Formula C36H23N3O2
Exact Mass 529.179027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DDOeXvgC7zE
Name 4-[(p-Cyanobenzoyl)oxy]-4-(p-cyanophenyl)-1,1,3-triphenyl-2-azabuta-1,3-diene
Alternate Name(s) (E)-1-(4-cyanophenyl)-2-[(diphenylmethylene)amino]-2-phenylethenyl 4-cyanobenzoate 4-[(p-Cyanobenzoyl)oxy]-4-(4;-cyanophenyl)-1,1,3-triphenyl-2-azabuta-1,3-diene
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Formula C36H23N3O2
InChI InChI=1S/C36H23N3O2/c37-24-26-16-20-31(21-17-26)35(41-36(40)32-22-18-27(25-38)19-23-32)34(30-14-8-3-9-15-30)39-33(28-10-4-1-5-11-28)29-12-6-2-7-13-29/h1-23H/b35-34+
InChIKey KZPHBJXNGMODDR-XAHDOWKMSA-N
Molecular Weight 529.599 g/mol
SMILES C(=N\C(=C/(OC(c1ccc(C#N)cc1)=O)c1ccc(C#N)cc1)c1ccccc1)(c1ccccc1)c1ccccc1
SPLASH splash10-00kb-0439020000-a4d628ceeced281196f3
Source of Spectrum Y4-91-377-5
Wiley ID 1550552