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1-[(4-BROMOPHENYL)CARBONYLMETYL]-3-BENZYL-2,1,3-BENZOTHIADIAZIN-4-ONE-2,2-DIOXIDE
SpectraBase Compound ID 4SOTHlMCckM
InChI InChI=1S/C22H17BrN2O4S/c23-18-12-10-17(11-13-18)21(26)15-24-20-9-5-4-8-19(20)22(27)25(30(24,28)29)14-16-6-2-1-3-7-16/h1-13H,14-15H2
InChIKey QOHYVMCAWJDFGN-UHFFFAOYSA-N
Mol Weight 485.35 g/mol
Molecular Formula C22H17BrN2O4S
Exact Mass 484.009241 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JKOX72c8oD5
Name 1-[(4-BROMOPHENYL)CARBONYLMETYL]-3-BENZYL-2,1,3-BENZOTHIADIAZIN-4-ONE-2,2-DIOXIDE
Compound Number 24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H17BrN2O4S
InChI InChI=1S/C22H17BrN2O4S/c23-18-12-10-17(11-13-18)21(26)15-24-20-9-5-4-8-19(20)22(27)25(30(24,28)29)14-16-6-2-1-3-7-16/h1-13H,14-15H2
InChIKey QOHYVMCAWJDFGN-UHFFFAOYSA-N
Literature Reference Author A.MARTINEZ,C.GIL,A.CASTRO,C.PEREZ,C.PRIETO,J.OTERO
Literature Reference Citation BIOORG.MED.CHEM.,11,2395(2003)
Literature Reference DOI 10.1016/s0968-0896(03)00148-2
Molecular Weight 485.352 g/mol
Solvent CDCl3
Source File Reference UWDB2041