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1-[(3,4-DICHLOROPHENYL)MEHYL]-3-ISOBUTYL-2,1,3-BENZOTHIADIAZIN-4-ONE-2,2-DIOXIDE
SpectraBase Compound ID GmLHGrqkeZH
InChI InChI=1S/C18H18Cl2N2O3S/c1-12(2)10-22-18(23)14-5-3-4-6-17(14)21(26(22,24)25)11-13-7-8-15(19)16(20)9-13/h3-9,12H,10-11H2,1-2H3
InChIKey QVHDVUHKRTZLNM-UHFFFAOYSA-N
Mol Weight 413.32 g/mol
Molecular Formula C18H18Cl2N2O3S
Exact Mass 412.041519 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4bS9gk8D1BW
Name 1-[(3,4-DICHLOROPHENYL)MEHYL]-3-ISOBUTYL-2,1,3-BENZOTHIADIAZIN-4-ONE-2,2-DIOXIDE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H18Cl2N2O3S
InChI InChI=1S/C18H18Cl2N2O3S/c1-12(2)10-22-18(23)14-5-3-4-6-17(14)21(26(22,24)25)11-13-7-8-15(19)16(20)9-13/h3-9,12H,10-11H2,1-2H3
InChIKey QVHDVUHKRTZLNM-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 413.319 g/mol
Solvent CDCl3
Source File Reference UWDB2036