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AESSNIGCAYIEMR-ZZGAQREKSA-N
SpectraBase Compound ID FZ6CQ3PRsqj
InChI InChI=1S/C28H22N4O8/c33-23-11-9-19(31(37)38)13-17(23)15-29-27(21-5-1-3-7-25(21)35)28(22-6-2-4-8-26(22)36)30-16-18-14-20(32(39)40)10-12-24(18)34/h1-16,27-28,33-36H/b29-15+,30-16+/t27-,28+
InChIKey AESSNIGCAYIEMR-ZZGAQREKSA-N
Mol Weight 542.5 g/mol
Molecular Formula C28H22N4O8
Exact Mass 542.143764 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4henZnySxZO
Name AESSNIGCAYIEMR-ZZGAQREKSA-N
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H22N4O8
InChI InChI=1S/C28H22N4O8/c33-23-11-9-19(31(37)38)13-17(23)15-29-27(21-5-1-3-7-25(21)35)28(22-6-2-4-8-26(22)36)30-16-18-14-20(32(39)40)10-12-24(18)34/h1-16,27-28,33-36H/b29-15+,30-16+/t27-,28+
InChIKey AESSNIGCAYIEMR-ZZGAQREKSA-N
Literature Reference Author Y.WOO,D.KOH,Y.LIM
Literature Reference Citation MAGN.RES.CHEM.,47,184(2009)
Literature Reference DOI 10.1002/mrc.2372
Molecular Weight 542.505 g/mol
Solvent DMSO-D6
Source File Reference UWLU79507