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5-DEOXY-PROTOBRUCEOL-III-HYDROPEROXIDE
SpectraBase Compound ID DLqS7s22kD2
InChI InChI=1S/2C19H20O5/c2*1-12(2)15(24-21)9-11-19(3)10-8-14-16(23-19)6-4-13-5-7-17(20)22-18(13)14/h2*4-8,10,15,21H,1,9,11H2,2-3H3/t2*15-,19?/m10/s1
InChIKey APVVBYDUDLDRLK-SMRATWGWSA-N
Mol Weight 656.73 g/mol
Molecular Formula C38H40O10
Exact Mass 656.262147 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CUH1bjipQ0t
Name 5-DEOXY-PROTOBRUCEOL-III-HYDROPEROXIDE
Compound Number 3/4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H40O10
InChI InChI=1S/2C19H20O5/c2*1-12(2)15(24-21)9-11-19(3)10-8-14-16(23-19)6-4-13-5-7-17(20)22-18(13)14/h2*4-8,10,15,21H,1,9,11H2,2-3H3/t2*15-,19?/m10/s1
InChIKey APVVBYDUDLDRLK-SMRATWGWSA-N
Literature Reference Author M.AHSAN,A.I.GRAY,G.LEACH,P.G.WATERMAN
Literature Reference Citation PHYTOCHEM.,36,777(1994)
Literature Reference DOI 10.1016/S0031-9422(00)89816-7
Molecular Weight 656.730 g/mol
Solvent CDCl3
Source File Reference UWMS25739