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ADWQAMDYGLRZEI-ULIFNZDWSA-N
SpectraBase Compound ID Cq0Fc3Ktye7
InChI InChI=1S/C30H26BrN3O3S/c1-2-36-26-15-13-25(14-16-26)34-29(35)20-38-30(34)22-8-17-28(37-19-21-6-4-3-5-7-21)27(18-22)33-32-24-11-9-23(31)10-12-24/h3-18,30H,2,19-20H2,1H3/b33-32+
InChIKey ADWQAMDYGLRZEI-ULIFNZDWSA-N
Mol Weight 588.52 g/mol
Molecular Formula C30H26BrN3O3S
Exact Mass 587.087826 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3erVdB5yBbw
Name ADWQAMDYGLRZEI-ULIFNZDWSA-N
Compound Number 4I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H26BrN3O3S
InChI InChI=1S/C30H26BrN3O3S/c1-2-36-26-15-13-25(14-16-26)34-29(35)20-38-30(34)22-8-17-28(37-19-21-6-4-3-5-7-21)27(18-22)33-32-24-11-9-23(31)10-12-24/h3-18,30H,2,19-20H2,1H3/b33-32+
InChIKey ADWQAMDYGLRZEI-ULIFNZDWSA-N
Literature Reference Author A.J.HUSSEIN,H.J.AZIZ
Literature Reference Citation D.CHEM.SINICA,2,136(2011)
Molecular Weight 588.519 g/mol
Solvent CDCl3
Source File Reference UWLU78227