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1-(p-acetamidophenyl)-3,4-dihydro-3-oxo-N-trityl-2(1H)-isoquinolinecarboxamide
SpectraBase Compound ID 2fXxR6Vw8ia
InChI InChI=1S/C37H31N3O3/c1-26(41)38-32-23-21-27(22-24-32)35-33-20-12-11-13-28(33)25-34(42)40(35)36(43)39-37(29-14-5-2-6-15-29,30-16-7-3-8-17-30)31-18-9-4-10-19-31/h2-24,35H,25H2,1H3,(H,38,41)(H,39,43)
InChIKey VXUJKMVZZHFIGN-UHFFFAOYSA-N
Mol Weight 565.7 g/mol
Molecular Formula C37H31N3O3
Exact Mass 565.236542 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4ifFkFTlVaj
Name 1-(p-ACETAMIDOPHENYL)-3,4-DIHYDRO-3-OXO-N-TRITYL-2(1H)ISOQUINOLINECARBOXAMIDE
Source of Sample E. Zara-Kaczian and G. Deak, Institute of Experimental Medicine, Budapest, Hungary
Comments Some carbon atoms are unassigned; Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H31N3O3
InChI InChI=1S/C37H31N3O3/c1-26(41)38-32-23-21-27(22-24-32)35-33-20-12-11-13-28(33)25-34(42)40(35)36(43)39-37(29-14-5-2-6-15-29,30-16-7-3-8-17-30)31-18-9-4-10-19-31/h2-24,35H,25H2,1H3,(H,38,41)(H,39,43)
InChIKey VXUJKMVZZHFIGN-UHFFFAOYSA-N
Melting Point 136-138C
Molecular Weight 565.68
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20