John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=Kep4hs0C4dk SpectraBase Spectrum ID=DIFYcVE2F8M

(accessed ).
KGCOJWFGNNDUBQ-ORXCEIOISA-N
SpectraBase Compound ID Kep4hs0C4dk
InChI InChI=1S/C30H44O15/c1-15(31)36-14-21-23(38-17(3)33)25(39-18(4)34)22(37-16(2)32)19(40-21)11-9-10-12-35-13-20-24-26(43-29(5,6)42-24)27-28(41-20)45-30(7,8)44-27/h9-10,19-28H,11-14H2,1-8H3/b10-9-/t19-,20+,21-,22+,23+,24-,25-,26-,27+,28+/m1/s1
InChIKey KGCOJWFGNNDUBQ-ORXCEIOISA-N
Mol Weight 644.7 g/mol
Molecular Formula C30H44O15
Exact Mass 644.268021 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DIFYcVE2F8M
Name KGCOJWFGNNDUBQ-ORXCEIOISA-N
Compound Number 26-CIS
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H44O15
InChI InChI=1S/C30H44O15/c1-15(31)36-14-21-23(38-17(3)33)25(39-18(4)34)22(37-16(2)32)19(40-21)11-9-10-12-35-13-20-24-26(43-29(5,6)42-24)27-28(41-20)45-30(7,8)44-27/h9-10,19-28H,11-14H2,1-8H3/b10-9-/t19-,20+,21-,22+,23+,24-,25-,26-,27+,28+/m1/s1
InChIKey KGCOJWFGNNDUBQ-ORXCEIOISA-N
Literature Reference Author R.ROY,R.DOMINIQUE,S.K.DAS
Literature Reference Citation J.ORG.CHEM.,64,5408(1999)
Literature Reference DOI 10.1021/jo9900984
Molecular Weight 644.670 g/mol
Sample ID 41266
Solvent CDCl3
SpectraBase Batch ID VK2M7Ts1i