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MIXTURE_OF_FOUR_DIASTEREOISOMERS
SpectraBase Compound ID 1qLlskLNR7X
InChI InChI=1S/4C9H13N3/c4*1-8(5-4-6-10)9(7-11)12(2)3/h4*4-5,8-9H,1-3H3/b4*5-4+
InChIKey NBOFUZAPLLANHZ-IYCYPFIPSA-N
Mol Weight 652.9 g/mol
Molecular Formula C36H52N12
Exact Mass 652.44379 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EiLNIUF6eE9
Name MIXTURE_OF_FOUR_DIASTEREOISOMERS
Compound Number 8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H52N12
InChI InChI=1S/4C9H13N3/c4*1-8(5-4-6-10)9(7-11)12(2)3/h4*4-5,8-9H,1-3H3/b4*5-4+
InChIKey NBOFUZAPLLANHZ-IYCYPFIPSA-N
Literature Reference Author A.JONCZYK,T.ZDROJEWSKI,P.GRZYWACZ,P.BALCERZAK
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2919(1996)
Literature Reference DOI 10.1039/p19960002919
Molecular Weight 652.889 g/mol
Solvent CDCl3
Source File Reference UWMZ3159