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K3zOGwCIbJl
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K3zOGwCIbJl
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13C NMR
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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DE-PARA-COUMAROYL-IBOTANOLIDE-HEXAACETATE
SpectraBase Compound ID DvH1hEQuE2m
InChI InChI=1S/C26H32O14/c1-13(27)33-10-9-19-7-8-20(21(11-19)35-15(3)29)39-26-25(38-18(6)32)24(37-17(5)31)23(36-16(4)30)22(40-26)12-34-14(2)28/h7-8,11,22-26H,9-10,12H2,1-6H3/t22-,23-,24+,25-,26-/m1/s1
InChIKey AOXKFMWFQIWQIQ-WSGIOKLISA-N
Mol Weight 568.5 g/mol
Molecular Formula C26H32O14
Exact Mass 568.179206 g/mol
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K3zOGwCIbJl
Name DE-PARA-COUMAROYL-IBOTANOLIDE-HEXAACETATE
Compound Number 4 A
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H32O14
InChI InChI=1S/C26H32O14/c1-13(27)33-10-9-19-7-8-20(21(11-19)35-15(3)29)39-26-25(38-18(6)32)24(37-17(5)31)23(36-16(4)30)22(40-26)12-34-14(2)28/h7-8,11,22-26H,9-10,12H2,1-6H3/t22-,23-,24+,25-,26-/m1/s1
InChIKey AOXKFMWFQIWQIQ-WSGIOKLISA-N
Literature Reference Author M.SUGIYAMA,M.KIKUCHI
Literature Reference Citation PHYTOCHEM.,30,3147(1991)
Literature Reference DOI 10.1016/S0031-9422(00)98275-X
Molecular Weight 568.532 g/mol
Solvent CDCl3
Source File Reference UWVN31089
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