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HIVBWCNAMKQRKY-ANDNKALQSA-N

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HIVBWCNAMKQRKY-ANDNKALQSA-N
SpectraBase Compound ID HREObvXoxaH
InChI InChI=1S/2C23H22FN3O2S/c2*24-21(30-17-11-5-2-6-12-17)20(15-16-9-3-1-4-10-16)26-22(28)18-13-7-8-14-19(18)23(29)27-25/h2*1-14,20-21H,15,25H2,(H,26,28)(H,27,29)/t2*20-,21?/m10/s1
InChIKey HIVBWCNAMKQRKY-ANDNKALQSA-N
Mol Weight 847.01 g/mol
Molecular Formula C46H44F2N6O4S2
Exact Mass 846.283353 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KB0f6OEcCbA
Name HIVBWCNAMKQRKY-ANDNKALQSA-N
Compound Number 42
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H44F2N6O4S2
InChI InChI=1S/2C23H22FN3O2S/c2*24-21(30-17-11-5-2-6-12-17)20(15-16-9-3-1-4-10-16)26-22(28)18-13-7-8-14-19(18)23(29)27-25/h2*1-14,20-21H,15,25H2,(H,26,28)(H,27,29)/t2*20-,21?/m10/s1
InChIKey HIVBWCNAMKQRKY-ANDNKALQSA-N
Literature Reference Author S.C.ANNEDI,W.LI,S.SAMSON,L.P.KOTRA
Literature Reference Citation J.ORG.CHEM.,68,1043(2003)
Literature Reference DOI 10.1021/jo026310c
Molecular Weight 847.010 g/mol
Solvent CDCl3
Source File Reference UWLU22915