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ZWDXFFXUSJKLKX-CMYVUFFQSA-N
SpectraBase Compound ID FimqN1saG87
InChI InChI=1S/C46H76N2O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-33-39-49-45-37-31-29-35-43(45)41-47-48-42-44-36-30-32-38-46(44)50-40-34-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h29-32,35-38,41-42H,3-28,33-34,39-40H2,1-2H3/b47-41+,48-42+
InChIKey ZWDXFFXUSJKLKX-CMYVUFFQSA-N
Mol Weight 689.1 g/mol
Molecular Formula C46H76N2O2
Exact Mass 688.59068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FVu4a5w0tbu
Name ZWDXFFXUSJKLKX-CMYVUFFQSA-N
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H76N2O2
InChI InChI=1S/C46H76N2O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-33-39-49-45-37-31-29-35-43(45)41-47-48-42-44-36-30-32-38-46(44)50-40-34-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h29-32,35-38,41-42H,3-28,33-34,39-40H2,1-2H3/b47-41+,48-42+
InChIKey ZWDXFFXUSJKLKX-CMYVUFFQSA-N
Literature Reference Author S.SENAPATI,B.K.MISHRA,G.B.BEHERA,P.P.MAHENDROO
Literature Reference Citation BULL.CH.SOC.JAP.,62,321(1989)
Literature Reference DOI 10.1246/bcsj.62.321
Molecular Weight 689.122 g/mol
Solvent CDCl3
Source File Reference UWCS9588