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3-CYCLOPROPYLCARBONYL-5-(2-AMINO-5-CHLOROPHENYL)-2,2-DIMETHYL-2,3-DIHYDRO-1,3,4-THIADIAZOLE
SpectraBase Compound ID 8Smi94AVRWJ
InChI InChI=1S/C14H16ClN3OS/c1-14(2)18(13(19)8-3-4-8)17-12(20-14)10-7-9(15)5-6-11(10)16/h5-8H,3-4,16H2,1-2H3
InChIKey AVSLEVRGBLDVTH-UHFFFAOYSA-N
Mol Weight 309.82 g/mol
Molecular Formula C14H16ClN3OS
Exact Mass 309.070261 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IblUTdxzsjo
Name 3-CYCLOPROPYLCARBONYL-5-(2-AMINO-5-CHLOROPHENYL)-2,2-DIMETHYL-2,3-DIHYDRO-1,3,4-THIADIAZOLE
Compound Number 43
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H16ClN3OS
InChI InChI=1S/C14H16ClN3OS/c1-14(2)18(13(19)8-3-4-8)17-12(20-14)10-7-9(15)5-6-11(10)16/h5-8H,3-4,16H2,1-2H3
InChIKey AVSLEVRGBLDVTH-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 309.814 g/mol
Solvent CDCl3
Source File Reference UWBT16281