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XVNPOZHTKGKFSZ-UXQVGZBCSA-N

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XVNPOZHTKGKFSZ-UXQVGZBCSA-N
SpectraBase Compound ID FI5MVwuEjPY
InChI InChI=1S/C34H50N2O2S/c1-29(11-7-15-31-17-21-37-23-31)13-9-19-33(26-35(3)4)25-34(39-28-33,27-36(5)6)20-10-14-30(2)12-8-16-32-18-22-38-24-32/h7-10,13-18,21-24,29-30H,11-12,19-20,25-28H2,1-6H3/b13-9+,14-10+,15-7+,16-8+
InChIKey XVNPOZHTKGKFSZ-UXQVGZBCSA-N
Mol Weight 550.8 g/mol
Molecular Formula C34H50N2O2S
Exact Mass 550.3593 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LAPeCJMMh3D
Name XVNPOZHTKGKFSZ-UXQVGZBCSA-N
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H50N2O2S
InChI InChI=1S/C34H50N2O2S/c1-29(11-7-15-31-17-21-37-23-31)13-9-19-33(26-35(3)4)25-34(39-28-33,27-36(5)6)20-10-14-30(2)12-8-16-32-18-22-38-24-32/h7-10,13-18,21-24,29-30H,11-12,19-20,25-28H2,1-6H3/b13-9+,14-10+,15-7+,16-8+
InChIKey XVNPOZHTKGKFSZ-UXQVGZBCSA-N
Literature Reference Author J.CYBULSKI,K.WOJTASIEWICZ,J.T.WROBEL
Literature Reference Citation HETEROCYCLES,22,2541(1984)
Literature Reference DOI 10.3987/R-1984-11-2541
Molecular Weight 550.843 g/mol
Solvent CDCl3
Source File Reference UWCS9361