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XMJTZYOZEOVCNG-PSVFENSKSA-N
SpectraBase Compound ID G9qYmJQ2CO5
InChI InChI=1S/C22H22O8/c1-25-15-7-11-17(21(27-3)20(15)26-2)16(12-8-28-22(24)18(12)19(11)23)10-4-5-13-14(6-10)30-9-29-13/h4-7,12,16,18-19,23H,8-9H2,1-3H3/t12-,16-,18+,19-/m1/s1
InChIKey XMJTZYOZEOVCNG-PSVFENSKSA-N
Mol Weight 414.41 g/mol
Molecular Formula C22H22O8
Exact Mass 414.131468 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ce0bfersQ
Name XMJTZYOZEOVCNG-PSVFENSKSA-N
Compound Number 26
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22O8
InChI InChI=1S/C22H22O8/c1-25-15-7-11-17(21(27-3)20(15)26-2)16(12-8-28-22(24)18(12)19(11)23)10-4-5-13-14(6-10)30-9-29-13/h4-7,12,16,18-19,23H,8-9H2,1-3H3/t12-,16-,18+,19-/m1/s1
InChIKey XMJTZYOZEOVCNG-PSVFENSKSA-N
Literature Reference Author A.SANFELICIANO,J.M.M.DELCORRAL,M.GORDALIZA,M.A.CASTRO
Literature Reference Citation MAGN.RES.CHEM.,31,868(1993)
Literature Reference DOI 10.1002/mrc.1260310915
Molecular Weight 414.412 g/mol
Solvent CDCl3
Source File Reference UWPR75