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ISOMER-#1
SpectraBase Compound ID JrRsix3HBOY
InChI InChI=1S/C28H28N4O8/c1-39-21(34)16-30-23-22(25(35)31(27(30)37)15-18-11-7-4-8-12-18)19-13-20(33)29(14-17-9-5-3-6-10-17)28(38)32(19)24(23)26(36)40-2/h3-12,19,22-24H,13-16H2,1-2H3
InChIKey UNERYBOZRUTESR-UHFFFAOYSA-N
Mol Weight 548.55 g/mol
Molecular Formula C28H28N4O8
Exact Mass 548.190714 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7qvVT1VUUXt
Name ISOMER-#2
Compound Number 5C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H28N4O8
InChI InChI=1S/C28H28N4O8/c1-39-21(34)16-30-23-22(25(35)31(27(30)37)15-18-11-7-4-8-12-18)19-13-20(33)29(14-17-9-5-3-6-10-17)28(38)32(19)24(23)26(36)40-2/h3-12,19,22-24H,13-16H2,1-2H3
InChIKey UNERYBOZRUTESR-UHFFFAOYSA-N
Literature Reference Author G.GRANGIER,D.J.AITKEN,D.GUILLAUME,A.TOMAS,B.VIOSSAT,H.P.HUSS ON
Literature Reference Citation J.HETCYCL.CHEM.,31,1707(1994)
Literature Reference DOI 10.1002/jhet.5570310673
Molecular Weight 548.552 g/mol
Solvent CDCl3
Source File Reference UWCS19400