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CALYSTEGIN_A1;8-AZABICYCLO-(3.2.1)-OCTAN-1.2.3-TRIOL
SpectraBase Compound ID 9iMPVziSCuC
InChI InChI=1S/C7H13NO3/c9-5-3-4-1-2-7(11,8-4)6(5)10/h4-6,8-11H,1-3H2/t4-,5+,6+,7+/m0/s1
InChIKey XOCBOVUINUHZJA-BDVNFPICSA-N
Mol Weight 159.18 g/mol
Molecular Formula C7H13NO3
Exact Mass 159.089543 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E7THvxoE1Oq
Name CALYSTEGIN_A1;8-AZABICYCLO-(3.2.1)-OCTAN-1.2.3-TRIOL
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H13NO3
InChI InChI=1S/C7H13NO3/c9-5-3-4-1-2-7(11,8-4)6(5)10/h4-6,8-11H,1-3H2/t4-,5+,6+,7+/m0/s1
InChIKey XOCBOVUINUHZJA-BDVNFPICSA-N
Literature Reference Author A.GOLDMANN,M.L.MILAT,P.H.DUCROT,J.Y.LALLEMAND,M.MAILLE,A.LEP INGLE,I.CHARPIN,D.TE
Literature Reference Citation PHYTOCHEM.,29,2125(1990)
Literature Reference DOI 10.1016/0031-9422(90)83019-W
Molecular Weight 159.185 g/mol
Solvent D2O
Source File Reference UWMZ22299