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o-Ethyl-[[N-(phthalimidomethyl)-N'-tritylamino]-methyl]-phosphonate

View entire compound with spectra: 2 NMR

o-Ethyl-[[N-(phthalimidomethyl)-N'-tritylamino]-methyl]-phosphonate
SpectraBase Compound ID GehhDEnz4IV
InChI InChI=1S/C31H29N2O4P/c1-2-37-38(36,23-33-29(34)27-20-12-13-21-28(27)30(33)35)22-32-31(24-14-6-3-7-15-24,25-16-8-4-9-17-25)26-18-10-5-11-19-26/h3-21,32H,2,22-23H2,1H3
InChIKey MJOFVUGLSMTFJI-UHFFFAOYSA-N
Mol Weight 524.56 g/mol
Molecular Formula C31H29N2O4P
Exact Mass 524.186494 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BXaCy1xP5yT
Name o-Ethyl-[[N-(phthalimidomethyl)-N'-tritylamino]-methyl]-phosphonate
Comments Computed using HOSE algorithm
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Exact Mass 524.186494416 u
Formula C31H29N2O4P
InChI InChI=1S/C31H29N2O4P/c1-2-37-38(36,23-33-29(34)27-20-12-13-21-28(27)30(33)35)22-32-31(24-14-6-3-7-15-24,25-16-8-4-9-17-25)26-18-10-5-11-19-26/h3-21,32H,2,22-23H2,1H3
InChIKey MJOFVUGLSMTFJI-UHFFFAOYSA-N
Molecular Weight 524.557 g/mol
SMILES C(NCP(=O)(CN1C(=O)C2=CC=CC=C2C1=O)OCC)(C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1