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IZJOOHFRLLJXEG-ZSTKHFORSA-N
SpectraBase Compound ID 2CxfLgFKRdG
InChI InChI=1S/C31H40O12/c1-14(32)39-24-25(40-15(2)33)27(41-16(3)34)30(43-26(24)29(37)38-5)42-23-13-22-21-8-6-17-12-18(35)7-9-19(17)20(21)10-11-31(22,4)28(23)36/h7,9,12,20-28,30,35-36H,6,8,10-11,13H2,1-5H3/t20?,21?,22?,23-,24+,25+,26+,27-,28-,30-,31+/m1/s1
InChIKey IZJOOHFRLLJXEG-ZSTKHFORSA-N
Mol Weight 604.6 g/mol
Molecular Formula C31H40O12
Exact Mass 604.251977 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F0q7XbpB6Lk
Name IZJOOHFRLLJXEG-ZSTKHFORSA-N
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H40O12
InChI InChI=1S/C31H40O12/c1-14(32)39-24-25(40-15(2)33)27(41-16(3)34)30(43-26(24)29(37)38-5)42-23-13-22-21-8-6-17-12-18(35)7-9-19(17)20(21)10-11-31(22,4)28(23)36/h7,9,12,20-28,30,35-36H,6,8,10-11,13H2,1-5H3/t20?,21?,22?,23-,24+,25+,26+,27-,28-,30-,31+/m1/s1
InChIKey IZJOOHFRLLJXEG-ZSTKHFORSA-N
Literature Reference Author W.YINQIU,J.M.WATERS,L.F.BLACKWELL
Literature Reference Citation J.CHEM.SOC.PERKIN-2,1449(1996)
Literature Reference DOI 10.1039/p29960001449
Molecular Weight 604.651 g/mol
Solvent Unknown
Source File Reference UWCP1836