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Diethyl 2-(1-(4-nitrobenzylidene)-2-phenylhydrazine-1-yl)-3-(triphenylphosphoranylidene)butandioate
SpectraBase Compound ID JyRlteI3BXX
InChI InChI=1S/C39H36N3O6P/c1-3-47-38(43)36(41(31-17-9-5-10-18-31)40-29-30-25-27-32(28-26-30)42(45)46)37(39(44)48-4-2)49(33-19-11-6-12-20-33,34-21-13-7-14-22-34)35-23-15-8-16-24-35/h5-29,36H,3-4H2,1-2H3
InChIKey KXQLRWFTWYRCLI-UHFFFAOYSA-N
Mol Weight 673.7 g/mol
Molecular Formula C39H36N3O6P
Exact Mass 673.234173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Txqic2pzKg
Name Diethyl 2-(1-(4-nitrobenzylidene)-2-phenylhydrazine-1-yl)-3-(triphenylphosphoranylidene)butandioate
Appearance Colorless crystals
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Formula C39H36N3O6P
InChI InChI=1S/C39H36N3O6P/c1-3-47-38(43)36(41(31-17-9-5-10-18-31)40-29-30-25-27-32(28-26-30)42(45)46)37(39(44)48-4-2)49(33-19-11-6-12-20-33,34-21-13-7-14-22-34)35-23-15-8-16-24-35/h5-29,36H,3-4H2,1-2H3
InChIKey KXQLRWFTWYRCLI-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP 5050A
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0010.709
Molecular Weight 673.706 g/mol
SMILES C(C(C(OCC)=O)=P(c1ccccc1)(c1ccccc1)c1ccccc1)(C(OCC)=O)N(N=Cc1ccc(cc1)[N+]([O-])=O)c1ccccc1
SPLASH splash10-004i-9892000000-39be58f7037c47b3df00
Source of Spectrum ARK-2009-93-3g
Wiley ID 1866644