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ZQWIDJNSMNTDST-AUSJPIAWSA-N
SpectraBase Compound ID zy1SZliRnb
InChI InChI=1S/C22H21NO7/c1-25-18-4-11(5-19(26-2)22(18)27-3)20-12-6-16-17(29-10-28-16)7-13(12)21-15(9-30-23-21)14(20)8-24/h4-8,14-15,20H,9-10H2,1-3H3/t14-,15-,20+/m0/s1
InChIKey ZQWIDJNSMNTDST-AUSJPIAWSA-N
Mol Weight 411.41 g/mol
Molecular Formula C22H21NO7
Exact Mass 411.131802 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3my0G8DNWHn
Name ZQWIDJNSMNTDST-AUSJPIAWSA-N
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H21NO7
InChI InChI=1S/C22H21NO7/c1-25-18-4-11(5-19(26-2)22(18)27-3)20-12-6-16-17(29-10-28-16)7-13(12)21-15(9-30-23-21)14(20)8-24/h4-8,14-15,20H,9-10H2,1-3H3/t14-,15-,20+/m0/s1
InChIKey ZQWIDJNSMNTDST-AUSJPIAWSA-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 411.411 g/mol
Solvent CDCl3
Source File Reference UWCP3522