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HMCDIALALPZIMW-UHFFFAOYSA-N

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HMCDIALALPZIMW-UHFFFAOYSA-N
SpectraBase Compound ID Wchz3lIXy8
InChI InChI=1S/C35H23N3O2S2/c39-34(24-9-5-22(6-10-24)32-3-1-17-41-32)36-28-15-13-26-19-27-14-16-29(21-31(27)38-30(26)20-28)37-35(40)25-11-7-23(8-12-25)33-4-2-18-42-33/h1-21H,(H,36,39)(H,37,40)
InChIKey HMCDIALALPZIMW-UHFFFAOYSA-N
Mol Weight 581.7 g/mol
Molecular Formula C35H23N3O2S2
Exact Mass 581.123169 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9hF9sSipzVM
Name HMCDIALALPZIMW-UHFFFAOYSA-N
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H23N3O2S2
InChI InChI=1S/C35H23N3O2S2/c39-34(24-9-5-22(6-10-24)32-3-1-17-41-32)36-28-15-13-26-19-27-14-16-29(21-31(27)38-30(26)20-28)37-35(40)25-11-7-23(8-12-25)33-4-2-18-42-33/h1-21H,(H,36,39)(H,37,40)
InChIKey HMCDIALALPZIMW-UHFFFAOYSA-N
Literature Reference Author Y.BENCHABANE,G.BOYER,R.FAURE
Literature Reference Citation MAGN.RES.CHEM.,47,706(2009)
Literature Reference DOI 10.1002/mrc.2441
Molecular Weight 581.707 g/mol
Solvent DMSO-D6
Source File Reference UWLU79865