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IFZXDRBWOKWHPR-UHFFFAOYSA-N

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IFZXDRBWOKWHPR-UHFFFAOYSA-N
SpectraBase Compound ID KXXbmUoPgjv
InChI InChI=1S/2C16H13N3S.Zn/c2*1-19-13-8-4-2-6-11(13)17-15(19)10-16-18-12-7-3-5-9-14(12)20-16;/h2*2-9H,10H2,1H3;/q;;+2
InChIKey IFZXDRBWOKWHPR-UHFFFAOYSA-N
Mol Weight 624.1 g/mol
Molecular Formula C32H26N6S2Zn
Exact Mass 622.095179 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3zKgpcXqnJ0
Name IFZXDRBWOKWHPR-UHFFFAOYSA-N
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H26N6S2Zn
InChI InChI=1S/2C16H13N3S.Zn/c2*1-19-13-8-4-2-6-11(13)17-15(19)10-16-18-12-7-3-5-9-14(12)20-16;/h2*2-9H,10H2,1H3;/q;;+2
InChIKey IFZXDRBWOKWHPR-UHFFFAOYSA-N
Literature Reference Author A.ABBOTTO,S.BRADAMANTE,A.FACCHETTI,G.A.PAGANI
Literature Reference Citation J.ORG.CHEM.,67,5753(2002)
Literature Reference DOI 10.1021/jo025696o
Molecular Weight 624.099 g/mol
Solvent CDCl3
Source File Reference UWSI22917