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2-(1-anilino-1,3-dioxobutan-2-yl)-3-triphenylphosphoranylidenebutanedioic acid dimethyl ester
SpectraBase Compound ID LYp3SjVvsum
InChI InChI=1S/C34H32NO6P/c1-24(36)29(32(37)35-25-16-8-4-9-17-25)30(33(38)40-2)31(34(39)41-3)42(26-18-10-5-11-19-26,27-20-12-6-13-21-27)28-22-14-7-15-23-28/h4-23,29-30H,1-3H3,(H,35,37)
InChIKey JMBZTADTCHYLNZ-UHFFFAOYSA-N
Mol Weight 581.6 g/mol
Molecular Formula C34H32NO6P
Exact Mass 581.196725 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ppVBZ9NOC
Name 2-(1-anilino-1,3-dioxobutan-2-yl)-3-triphenylphosphoranylidenebutanedioic acid dimethyl ester
Alternate Name(s) 2-[2-keto-1-(phenylcarbamoyl)propyl]-3-triphenylphosphoranylidene-succinic acid dimethyl ester Dimethyl 2-(1-anilino-1,3-dioxobutan-2-yl)-3-(triphenyl-$l^{5}-phosphanylidene)butanedioate Dimethyl 2-[2-oxo-1-(phenylcarbamoyl)propyl]-3-(triphenyl-$l^{5}-phosphanylidene)butanedioate
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Formula C34H32NO6P
InChI InChI=1S/C34H32NO6P/c1-24(36)29(32(37)35-25-16-8-4-9-17-25)30(33(38)40-2)31(34(39)41-3)42(26-18-10-5-11-19-26,27-20-12-6-13-21-27)28-22-14-7-15-23-28/h4-23,29-30H,1-3H3,(H,35,37)
InChIKey JMBZTADTCHYLNZ-UHFFFAOYSA-N
Molecular Weight 581.605 g/mol
SMILES N(C(C(C(C(=P(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)OC)C(=O)OC)C(=O)C)=O)c1ccccc1
SPLASH splash10-03e9-0970000000-6c4fb7c1db7e2055ce23
Source of Spectrum F-55-11856-4
Wiley ID 839347