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2-[1-BENZYL-2-FLUORO-2-(PHENYLSULFANYL)-ETHYL]-ISOINDOLE-1,3-DIONE
SpectraBase Compound ID DBlBh4gt33n
InChI InChI=1S/2C23H18FNO2S/c2*24-21(28-17-11-5-2-6-12-17)20(15-16-9-3-1-4-10-16)25-22(26)18-13-7-8-14-19(18)23(25)27/h2*1-14,20-21H,15H2/t2*20-,21?/m11/s1
InChIKey KTGUJVSTYWVVCF-LBJUETGLSA-N
Mol Weight 782.92 g/mol
Molecular Formula C46H36F2N2O4S2
Exact Mass 782.208456 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KdNfXUTY3Q2
Name 2-[1-BENZYL-2-FLUORO-2-(PHENYLSULFANYL)-ETHYL]-ISOINDOLE-1,3-DIONE
Compound Number 37
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H36F2N2O4S2
InChI InChI=1S/2C23H18FNO2S/c2*24-21(28-17-11-5-2-6-12-17)20(15-16-9-3-1-4-10-16)25-22(26)18-13-7-8-14-19(18)23(25)27/h2*1-14,20-21H,15H2/t2*20-,21?/m11/s1
InChIKey KTGUJVSTYWVVCF-LBJUETGLSA-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 782.920 g/mol
Solvent CDCl3
Source File Reference UWLU22910