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IVHSSCUMYDHEGB-UKEBODGPSA-N
SpectraBase Compound ID LRuVLTZ4qsG
InChI InChI=1S/C31H34O14/c1-31(2,20-12-16-11-15-6-8-22(33)44-28(15)27(38)29(16)43-20)45-30-26(37)25(36)24(35)19(42-30)13-41-21(32)7-5-14-9-17(39-3)23(34)18(10-14)40-4/h5-11,19-20,24-26,30,34-38H,12-13H2,1-4H3/b7-5+/t19-,20?,24-,25+,26-,30+/m1/s1
InChIKey IVHSSCUMYDHEGB-UKEBODGPSA-N
Mol Weight 630.6 g/mol
Molecular Formula C31H34O14
Exact Mass 630.194856 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 57xHDrwtslB
Name IVHSSCUMYDHEGB-UKEBODGPSA-N
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H34O14
InChI InChI=1S/C31H34O14/c1-31(2,20-12-16-11-15-6-8-22(33)44-28(15)27(38)29(16)43-20)45-30-26(37)25(36)24(35)19(42-30)13-41-21(32)7-5-14-9-17(39-3)23(34)18(10-14)40-4/h5-11,19-20,24-26,30,34-38H,12-13H2,1-4H3/b7-5+/t19-,20?,24-,25+,26-,30+/m1/s1
InChIKey IVHSSCUMYDHEGB-UKEBODGPSA-N
Literature Reference Author J.REISCH,S.H.ACHENBACH
Literature Reference Citation PHYTOCHEM.,31,4376(1992)
Literature Reference DOI 10.1016/0031-9422(92)80484-V
Molecular Weight 630.603 g/mol
Solvent ACETONE-D6
Source File Reference UWVN26832