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Triphenylphosphonium 1-(2,4-dichlorophenylazo)-1-ethoxycarbonylmethylide

View entire compound with spectra: 2 NMR

Triphenylphosphonium 1-(2,4-dichlorophenylazo)-1-ethoxycarbonylmethylide
SpectraBase Compound ID 2Bb8X7zrIMB
InChI InChI=1S/C28H23Cl2N2O2P/c1-2-34-28(33)27(32-31-26-19-18-21(29)20-25(26)30)35(22-12-6-3-7-13-22,23-14-8-4-9-15-23)24-16-10-5-11-17-24/h3-20H,2H2,1H3
InChIKey RYOMBVGOMRVGCN-UHFFFAOYSA-N
Mol Weight 521.38 g/mol
Molecular Formula C28H23Cl2N2O2P
Exact Mass 520.08742 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DgU2QJEWslj
Name Triphenylphosphonium 1-(2,4-dichlorophenylazo)-1-ethoxycarbonylmethylide
Comments Computed using HOSE algorithm
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Exact Mass 520.087420385 u
Formula C28H23Cl2N2O2P
InChI InChI=1S/C28H23Cl2N2O2P/c1-2-34-28(33)27(32-31-26-19-18-21(29)20-25(26)30)35(22-12-6-3-7-13-22,23-14-8-4-9-15-23)24-16-10-5-11-17-24/h3-20H,2H2,1H3
InChIKey RYOMBVGOMRVGCN-UHFFFAOYSA-N
Molecular Weight 521.384 g/mol
SMILES C(=P(c1ccccc1)(c1ccccc1)c1ccccc1)(N=Nc1c(cc(cc1)Cl)Cl)C(=O)OCC