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PHNZCXCOVMFXDO-WCSAPBTDSA-N
SpectraBase Compound ID 77JRpgK9ot
InChI InChI=1S/C25H27NO10/c1-12(27)34-10-16-22(25(28)33-5)21(13-6-19(30-2)24(32-4)20(7-13)31-3)14-8-17-18(36-11-35-17)9-15(14)23(16)26-29/h6-9,16,21-22,29H,10-11H2,1-5H3/b26-23+/t16-,21+,22+/m0/s1
InChIKey PHNZCXCOVMFXDO-WCSAPBTDSA-N
Mol Weight 501.49 g/mol
Molecular Formula C25H27NO10
Exact Mass 501.163496 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IoEWhtuhAKZ
Name PHNZCXCOVMFXDO-WCSAPBTDSA-N
Compound Number 31
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H26NO10
InChI InChI=1S/C25H27NO10/c1-12(27)34-10-16-22(25(28)33-5)21(13-6-19(30-2)24(32-4)20(7-13)31-3)14-8-17-18(36-11-35-17)9-15(14)23(16)26-29/h6-9,16,21-22,29H,10-11H2,1-5H3/b26-23+/t16-,21+,22+/m0/s1
InChIKey PHNZCXCOVMFXDO-WCSAPBTDSA-N
Literature Reference Author M.A.CASTRO,J.M.M.DELCORRAL,M.L.LOPEZ-VAZQUEZ,P.A.GARCIA,A.SA NFELICIANO,M.GORDALI
Literature Reference Citation MAGN.RES.CHEM.,35,808(1997)
Literature Reference DOI 10.1002/(sici)1097-458x(199711)35:11<808::aid-omr165>3.0.co;2-l
Molecular Weight 500.482 g/mol
Solvent CDCl3
Source File Reference UWCP3531