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3-PROPYLCARBONYL-5-(2-NITRO-5-METHOXYPHENYL)-2,2-DIMETHYL-2,3-DIHYDRO-1,3,4-THIADIAZOLE
SpectraBase Compound ID 9ZNlbFTdVFK
InChI InChI=1S/C15H19N3O4S/c1-5-6-13(19)17-15(2,3)23-14(16-17)11-9-10(22-4)7-8-12(11)18(20)21/h7-9H,5-6H2,1-4H3
InChIKey JYVJMMPFGPTLCU-UHFFFAOYSA-N
Mol Weight 337.39 g/mol
Molecular Formula C15H19N3O4S
Exact Mass 337.109627 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EM775nNuNBh
Name 3-PROPYLCARBONYL-5-(2-NITRO-5-METHOXYPHENYL)-2,2-DIMETHYL-2,3-DIHYDRO-1,3,4-THIADIAZOLE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H19N3O4S
InChI InChI=1S/C15H19N3O4S/c1-5-6-13(19)17-15(2,3)23-14(16-17)11-9-10(22-4)7-8-12(11)18(20)21/h7-9H,5-6H2,1-4H3
InChIKey JYVJMMPFGPTLCU-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 337.394 g/mol
Solvent CDCl3
Source File Reference UWBT16243