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ACALEBXALXVWRS-CDVLHVEZSA-N
SpectraBase Compound ID f4iw7WN8XC
InChI InChI=1S/C36H62O11/c1-10-20(2)34-22(4)13-14-36(47-34)18-26(38)15-27(46-36)12-11-21(3)33(23(5)19-37)44-31-17-29(41-9)35(25(7)43-31)45-30-16-28(40-8)32(39)24(6)42-30/h11,19-20,22-35,38-39H,10,12-18H2,1-9H3/b21-11+/t20-,22+,23+,24-,25+,26+,27-,28-,29+,30-,31+,32-,33-,34-,35+,36-/m1/s1
InChIKey ACALEBXALXVWRS-CDVLHVEZSA-N
Mol Weight 670.9 g/mol
Molecular Formula C36H62O11
Exact Mass 670.429213 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EXHiJUZJfZn
Name ACALEBXALXVWRS-CDVLHVEZSA-N
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H62O11
InChI InChI=1S/C36H62O11/c1-10-20(2)34-22(4)13-14-36(47-34)18-26(38)15-27(46-36)12-11-21(3)33(23(5)19-37)44-31-17-29(41-9)35(25(7)43-31)45-30-16-28(40-8)32(39)24(6)42-30/h11,19-20,22-35,38-39H,10,12-18H2,1-9H3/b21-11+/t20-,22+,23+,24-,25+,26+,27-,28-,29+,30-,31+,32-,33-,34-,35+,36-/m1/s1
InChIKey ACALEBXALXVWRS-CDVLHVEZSA-N
Literature Reference Author A.R.D.SANTOS,M.D.L.G.FERREIRA,C.R.KAISER,J.P.FEREZOU
Literature Reference Citation EUR.J.ORG.CHEM.,3348(2005)
Molecular Weight 670.882 g/mol
Sample ID 30081
Solvent CDCl3