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Ethyl .alpha.-[(triphenylphosphoranylidene)amino]-.beta.[3-(1,4,9-trimethyl)carbazoyl]acrylate
SpectraBase Compound ID FImmIhDcZRP
InChI InChI=1S/C38H35N2O2P/c1-5-42-38(41)34(26-29-25-27(2)37-36(28(29)3)33-23-15-16-24-35(33)40(37)4)39-43(30-17-9-6-10-18-30,31-19-11-7-12-20-31)32-21-13-8-14-22-32/h6-26H,5H2,1-4H3/b34-26+
InChIKey GILGQOBCHRXIBQ-JJNGWGCYSA-N
Mol Weight 582.7 g/mol
Molecular Formula C38H35N2O2P
Exact Mass 582.243615 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hs53l1dQxno
Name Ethyl .alpha.-[(triphenylphosphoranylidene)amino]-.beta.[3-(1,4,9-trimethyl)carbazoyl]acrylate
Comments Computed using HOSE algorithm
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Exact Mass 582.243615371 u
Formula C38H35N2O2P
InChI InChI=1S/C38H35N2O2P/c1-5-42-38(41)34(26-29-25-27(2)37-36(28(29)3)33-23-15-16-24-35(33)40(37)4)39-43(30-17-9-6-10-18-30,31-19-11-7-12-20-31)32-21-13-8-14-22-32/h6-26H,5H2,1-4H3/b34-26+
InChIKey GILGQOBCHRXIBQ-JJNGWGCYSA-N
Molecular Weight 582.684 g/mol
SMILES C1=2N(C3=C(C2C(C)=C(\C=C/(N=P(C2=CC=CC=C2)(C2=CC=CC=C2)C=2C=CC=CC2)C(=O)OCC)C=C1C)C=CC=C3)C