John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=HVcs5WaUlKn SpectraBase Spectrum ID=FB0uxb29mkw

(accessed ).
CFWYVGNOQCIWJE-JMXJFVEPSA-N
SpectraBase Compound ID HVcs5WaUlKn
InChI InChI=1S/2C14H24N2O7S/c2*1-3-24-6-8-4-5-23-14(9(18)12(2,21)7-17)11(20)15-13(8,22)10(19)16-14/h2*8-9,17-18,21-22H,3-7H2,1-2H3,(H,15,20)(H,16,19)/t8?,9?,12?,13-,14+;8?,9?,12?,13-,14-/m11/s1
InChIKey CFWYVGNOQCIWJE-JNXIJPLWSA-N
Mol Weight 728.83 g/mol
Molecular Formula C28H48N4O14S2
Exact Mass 728.260846 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FB0uxb29mkw
Name CFWYVGNOQCIWJE-JMXJFVEPSA-N
Compound Number 30
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H48N4O14S2
InChI InChI=1S/2C14H24N2O7S/c2*1-3-24-6-8-4-5-23-14(9(18)12(2,21)7-17)11(20)15-13(8,22)10(19)16-14/h2*8-9,17-18,21-22H,3-7H2,1-2H3,(H,15,20)(H,16,19)/t8?,9?,12?,13-,14+;8?,9?,12?,13-,14-/m11/s1
InChIKey CFWYVGNOQCIWJE-JNXIJPLWSA-N
Literature Reference Author Z.ZHANG,H.KOHN
Literature Reference Citation J.AM.CHEM.SOC.,116,9815(1994)
Literature Reference DOI 10.1021/ja00101a001
Molecular Weight 728.828 g/mol
Solvent CD3OD
Source File Reference UWSI774
SpectraBase Batch ID 631czBE26eI