For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-PHENYLCARBONYL-5-(2-AMINO-5-CHLOROPHENYL)-2,2-DIMETHYL-2,3-DIHYDRO-1,3,4-THIADIAZOLE
SpectraBase Compound ID KETVW4h6u4h
InChI InChI=1S/C17H16ClN3OS/c1-17(2)21(16(22)11-6-4-3-5-7-11)20-15(23-17)13-10-12(18)8-9-14(13)19/h3-10H,19H2,1-2H3
InChIKey SSUHYWIBJGELSN-UHFFFAOYSA-N
Mol Weight 345.85 g/mol
Molecular Formula C17H16ClN3OS
Exact Mass 345.070261 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID B8RBoKRETGv
Name 3-PHENYLCARBONYL-5-(2-AMINO-5-CHLOROPHENYL)-2,2-DIMETHYL-2,3-DIHYDRO-1,3,4-THIADIAZOLE
Compound Number 47
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H16ClN3OS
InChI InChI=1S/C17H16ClN3OS/c1-17(2)21(16(22)11-6-4-3-5-7-11)20-15(23-17)13-10-12(18)8-9-14(13)19/h3-10H,19H2,1-2H3
InChIKey SSUHYWIBJGELSN-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 345.847 g/mol
Solvent CDCl3
Source File Reference UWBT16285