John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=EUbkjizGOgT SpectraBase Spectrum ID=1JUByfpYioo

(accessed ).
CODIACYANOGLUCOSIDE;2-(3,4,5)-TRIHYDROXY-6-HYDROXYMETHYLTETRAHYDROPYRAN-2-YLOXYMETHYL)-ACRYLONITRILE
SpectraBase Compound ID EUbkjizGOgT
InChI InChI=1S/C10H15NO6/c1-5(2-11)4-16-10-9(15)8(14)7(13)6(3-12)17-10/h6-10,12-15H,1,3-4H2/t6-,7-,8+,9-,10-/m0/s1
InChIKey DBRWANAQMUPTPJ-CIQUZCHMSA-N
Mol Weight 245.23 g/mol
Molecular Formula C10H15NO6
Exact Mass 245.089937 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1JUByfpYioo
Name CODIACYANOGLUCOSIDE;2-(3,4,5)-TRIHYDROXY-6-HYDROXYMETHYLTETRAHYDROPYRAN-2-YLOXYMETHYL)-ACRYLONITRILE
Compound Number 1
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H15NO6
InChI InChI=1S/C10H15NO6/c1-5(2-11)4-16-10-9(15)8(14)7(13)6(3-12)17-10/h6-10,12-15H,1,3-4H2/t6-,7-,8+,9-,10-/m0/s1
InChIKey DBRWANAQMUPTPJ-CIQUZCHMSA-N
Literature Reference Author J.E.FORERO,L.AVILA,N.TABORDA,P.TABARES,A.LOPEZ,F.TORRES,W.QU INONES,M.A.BUCIO,Y.M
Literature Reference Citation PHYTOCHEM.,69,2815(2008)
Literature Reference DOI 10.1016/j.phytochem.2008.09.003
Molecular Weight 245.232 g/mol
Sample ID 63839
Solvent CD3OD
SpectraBase Batch ID 7foC40nMeZG