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3-BUTYLCARBONYL-5-(2-AMINOPHENYL)-2,2-DIMETHYL-2,3-DIHYDRO-1,3,4-THIADIAZOLE
SpectraBase Compound ID EcMsYmHgzMP
InChI InChI=1S/C15H21N3OS/c1-4-5-10-13(19)18-15(2,3)20-14(17-18)11-8-6-7-9-12(11)16/h6-9H,4-5,10,16H2,1-3H3
InChIKey IYFKSPCEPXUFAJ-UHFFFAOYSA-N
Mol Weight 291.41 g/mol
Molecular Formula C15H21N3OS
Exact Mass 291.140533 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Sdb2oH4HK8
Name 3-BUTYLCARBONYL-5-(2-AMINOPHENYL)-2,2-DIMETHYL-2,3-DIHYDRO-1,3,4-THIADIAZOLE
Compound Number 51
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H21N3OS
InChI InChI=1S/C15H21N3OS/c1-4-5-10-13(19)18-15(2,3)20-14(17-18)11-8-6-7-9-12(11)16/h6-9H,4-5,10,16H2,1-3H3
InChIKey IYFKSPCEPXUFAJ-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 291.411 g/mol
Solvent CDCl3
Source File Reference UWBT16289