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3-CYCLOBUTYLCARBONYL-5-(2-AMINO-5-CHLOROPHENYL)-2,2-DIMETHYL-2,3-DIHYDRO-1,3,4-THIADIAZOLE
SpectraBase Compound ID LYP9LcziXh5
InChI InChI=1S/C15H18ClN3OS/c1-15(2)19(14(20)9-4-3-5-9)18-13(21-15)11-8-10(16)6-7-12(11)17/h6-9H,3-5,17H2,1-2H3
InChIKey TZTAHVCRFCDQIC-UHFFFAOYSA-N
Mol Weight 323.84 g/mol
Molecular Formula C15H18ClN3OS
Exact Mass 323.085911 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1o2G0HaBm1E
Name 3-CYCLOBUTYLCARBONYL-5-(2-AMINO-5-CHLOROPHENYL)-2,2-DIMETHYL-2,3-DIHYDRO-1,3,4-THIADIAZOLE
Compound Number 44
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H18ClN3OS
InChI InChI=1S/C15H18ClN3OS/c1-15(2)19(14(20)9-4-3-5-9)18-13(21-15)11-8-10(16)6-7-12(11)17/h6-9H,3-5,17H2,1-2H3
InChIKey TZTAHVCRFCDQIC-UHFFFAOYSA-N
Literature Reference Author M.D.CARRION,L.C.LOPEZ-CARA,M.CHAYAH,D.CHOQUESILLO-LAZARTE,M. A.GALLO,A.ESPINOSA,A
Literature Reference Citation MAGN.RES.CHEM.,50,515(2012)
Literature Reference DOI 10.1002/mrc.3830
Molecular Weight 323.840 g/mol
Solvent CDCl3
Source File Reference UWBT16282