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Bis(iminophosphorane)

View entire compound with spectra: 2 MS (GC)

Bis(iminophosphorane)
SpectraBase Compound ID EkiCbT2SAsK
InChI InChI=1S/C51H44N4O2P2/c1-3-57-51(56)49(53-58(42-27-13-5-14-28-42,43-29-15-6-16-30-43)44-31-17-7-18-32-44)39-48-40(2)52-55(41-25-11-4-12-26-41)50(48)54-59(45-33-19-8-20-34-45,46-35-21-9-22-36-46)47-37-23-10-24-38-47/h4-39H,3H2,1-2H3/b49-39+
InChIKey ZZJTUOUNDOVRIG-WMDAMAIOSA-N
Mol Weight 806.9 g/mol
Molecular Formula C51H44N4O2P2
Exact Mass 806.293951 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I5ccBRK4TUt
Name Bis(iminophosphorane)
Alternate Name(s) Ethyl (2E)-3-{3-methyl-1-phenyl-5-[(triphenyl-phosphanylidene)amino]-1H-pyrazol-4-yl}-2-[(triphenyl-phosphanylidene)amino]prop-2-enoate
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Formula C51H44N4O2P2
InChI InChI=1S/C51H44N4O2P2/c1-3-57-51(56)49(53-58(42-27-13-5-14-28-42,43-29-15-6-16-30-43)44-31-17-7-18-32-44)39-48-40(2)52-55(41-25-11-4-12-26-41)50(48)54-59(45-33-19-8-20-34-45,46-35-21-9-22-36-46)47-37-23-10-24-38-47/h4-39H,3H2,1-2H3/b49-39+
InChIKey ZZJTUOUNDOVRIG-WMDAMAIOSA-N
Molecular Weight 806.887 g/mol
SMILES c1(c(\C=C/(N=P(c2ccccc2)(c2ccccc2)c2ccccc2)C(=O)OCC)c(C)n[n]1-c1ccccc1)N=P(c1ccccc1)(c1ccccc1)c1ccccc1
SPLASH splash10-0089-0900800000-00d7386ab66a1537bfd2
Source of Spectrum J-58-5268-2
Wiley ID 1417245