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PKQMOOXKXRHFGV-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

PKQMOOXKXRHFGV-UHFFFAOYSA-N
SpectraBase Compound ID ChcFoScoHdH
InChI InChI=1S/C44H48N4O4/c1-5-43-20-17-32(46-22-19-31-29-14-10-12-16-34(29)48(38(31)40(43)46)35(24-43)41(49)51-7-3)27-23-44(6-2)25-36(42(50)52-8-4)47-33-15-11-9-13-28(33)30-18-21-45(26-27)39(44)37(30)47/h9-16,24-26,32,39-40H,5-8,17-23H2,1-4H3
InChIKey PKQMOOXKXRHFGV-UHFFFAOYSA-N
Mol Weight 696.9 g/mol
Molecular Formula C44H48N4O4
Exact Mass 696.367556 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KUrM7URJojE
Name PKQMOOXKXRHFGV-UHFFFAOYSA-N
Compound Number 1C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H48N4O4
InChI InChI=1S/C44H48N4O4/c1-5-43-20-17-32(46-22-19-31-29-14-10-12-16-34(29)48(38(31)40(43)46)35(24-43)41(49)51-7-3)27-23-44(6-2)25-36(42(50)52-8-4)47-33-15-11-9-13-28(33)30-18-21-45(26-27)39(44)37(30)47/h9-16,24-26,32,39-40H,5-8,17-23H2,1-4H3
InChIKey PKQMOOXKXRHFGV-UHFFFAOYSA-N
Literature Reference Author I.MOLDVAI,C.SZANTAY-JR.,G.TOTH,A.VEDRES,A.KALMAN,C.SZANTAY
Literature Reference Citation REC.TR.CH.P.-B.,107,335(1988)
Literature Reference DOI 10.1002/recl.19881070407
Molecular Weight 696.890 g/mol
Solvent CDCl3
Source File Reference UNIW21128