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METHYL-(E)-5-CYCLOHEXYLIDENE-{4-[ETHOXYCARBONYLIMINO-(DIPHENYL)-LAMBDA(5)-PHOSPHANYL-2-OXO-2,5-DIHYDROPYRROL-3-YL}-ACETATE
SpectraBase Compound ID 78rdDTmAeiJ
InChI InChI=1S/C28H31N2O5P/c1-3-35-28(33)30-36(21-15-9-5-10-16-21,22-17-11-6-12-18-22)26-23(19-24(31)34-2)27(32)29-25(26)20-13-7-4-8-14-20/h5-6,9-12,15-18H,3-4,7-8,13-14,19H2,1-2H3,(H,29,32)
InChIKey DVMJODPKXVNLGZ-UHFFFAOYSA-N
Mol Weight 506.54 g/mol
Molecular Formula C28H31N2O5P
Exact Mass 506.197059 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2yvx0aWr1W0
Name 2-[4-[carbethoxyimino(diphenyl)phosphoranyl]-5-cyclohexylidene-2-keto-3-pyrrolin-3-yl]acetic acid methyl ester
Alternate Name(s) 2-[5-cyclohexylidene-4-[ethoxycarbonylimino(diphenyl)phosphoranyl]-2-oxo-3-pyrrolyl]acetic acid methyl ester Methyl 2-[5-cyclohexylidene-4-[ethoxycarbonylimino(diphenyl)-$l^{5}-phosphanyl]-2-oxopyrrol-3-yl]acetate Methyl 2-[5-cyclohexylidene-4-[ethoxycarbonylimino(diphenyl)-$l^{5}-phosphanyl]-2-oxo-pyrrol-3-yl]acetate
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Formula C28H31N2O5P
InChI InChI=1S/C28H31N2O5P/c1-3-35-28(33)30-36(21-15-9-5-10-16-21,22-17-11-6-12-18-22)26-23(19-24(31)34-2)27(32)29-25(26)20-13-7-4-8-14-20/h5-6,9-12,15-18H,3-4,7-8,13-14,19H2,1-2H3,(H,29,32)
InChIKey DVMJODPKXVNLGZ-UHFFFAOYSA-N
Molecular Weight 506.539 g/mol
SMILES N1C(C(=C(C1=C1CCCCC1)P(=NC(=O)OCC)(c1ccccc1)c1ccccc1)CC(=O)OC)=O
SPLASH splash10-001i-9030210000-72b260f3cfa9ce2de5fd
Source of Spectrum KC-0-1485-5
Wiley ID 786061