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ISOMER-ALPHA
SpectraBase Compound ID HYWXCF03T3P
InChI InChI=1S/C23H14N2O6/c26-18-12-5-1-2-6-13(12)19(27)21(18)17(16-11-24-9-10-25-16)22(29)20(28)14-7-3-4-8-15(14)23(22,30)31-21/h1-11,17,29-30H/t17-,22+,23?/m0/s1
InChIKey CPJKVJHQSHVHCL-IRXMKASPSA-N
Mol Weight 414.37 g/mol
Molecular Formula C23H14N2O6
Exact Mass 414.085186 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Qj40qOsukj
Name ISOMER-B
Compound Number 7D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H14N2O6
InChI InChI=1S/C23H14N2O6/c26-18-12-5-1-2-6-13(12)19(27)21(18)17(16-11-24-9-10-25-16)22(29)20(28)14-7-3-4-8-15(14)23(22,30)31-21/h1-11,17,29-30H/t17-,22+,23?/m0/s1
InChIKey CPJKVJHQSHVHCL-IRXMKASPSA-N
Literature Reference Author G.HEINISCH,W.HOLZER,K.MEREITER,B.STROBL,C.ZHENG
Literature Reference Citation HETEROCYCLES,43,1665(1996)
Literature Reference DOI 10.3987/COM-96-7488
Molecular Weight 414.374 g/mol
Solvent DMSO-D6
Source File Reference UWCP6658