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E-ISOMER

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E-ISOMER
SpectraBase Compound ID Jf5oF8GSorX
InChI InChI=1S/2C14H21NOS/c2*1-12(2)10-13(3)11-17(16,15-4)14-8-6-5-7-9-14/h2*5-10,12H,11H2,1-4H3/b2*13-10+
InChIKey JGAMZBHEUVTQSX-GJQXIAOISA-N
Mol Weight 502.78 g/mol
Molecular Formula C28H42N2O2S2
Exact Mass 502.268771 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4SH9XzcyV99
Name (E)-ISOMER
Compound Number 13A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H42N2O2S2
InChI InChI=1S/2C14H21NOS/c2*1-12(2)10-13(3)11-17(16,15-4)14-8-6-5-7-9-14/h2*5-10,12H,11H2,1-4H3/b2*13-10+
InChIKey JGAMZBHEUVTQSX-GJQXIAOISA-N
Literature Reference Author H.J.GAIS,L.R.REDDY,G.S.BABU,G.RAABE
Literature Reference Citation J.AM.CHEM.SOC.,126,4859(2004)
Literature Reference DOI 10.1021/ja030501v
Molecular Weight 502.774 g/mol
Solvent CDCl3
Source File Reference UWVN32108