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1-(6'-METHYLBENZOTHIAZOL-2'-YL)-5-(PARA-CHLOROPHENYL)-3-TRIFLUOROMETHYL-PYRAZOLE

View entire compound with spectra: 2 NMR

1-(6'-METHYLBENZOTHIAZOL-2'-YL)-5-(PARA-CHLOROPHENYL)-3-TRIFLUOROMETHYL-PYRAZOLE
SpectraBase Compound ID FiKKtWFm7vz
InChI InChI=1S/C18H11ClF3N3S/c1-10-2-7-13-15(8-10)26-17(23-13)25-14(9-16(24-25)18(20,21)22)11-3-5-12(19)6-4-11/h2-9H,1H3
InChIKey ATPFLOMOKPANBM-UHFFFAOYSA-N
Mol Weight 393.82 g/mol
Molecular Formula C18H11ClF3N3S
Exact Mass 393.031431 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KVKK6SHILi5
Name 1-(6'-METHYLBENZOTHIAZOL-2'-YL)-5-(PARA-CHLOROPHENYL)-3-TRIFLUOROMETHYL-PYRAZOLE
Compound Number 9C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H11ClF3N3S
InChI InChI=1S/C18H11ClF3N3S/c1-10-2-7-13-15(8-10)26-17(23-13)25-14(9-16(24-25)18(20,21)22)11-3-5-12(19)6-4-11/h2-9H,1H3
InChIKey ATPFLOMOKPANBM-UHFFFAOYSA-N
Literature Reference Author S.P.SINGH,V.KUMAR,R.AGGARWAL,J.ELGUERO
Literature Reference Citation J.HETCYCL.CHEM.,43,1003(2006)
Literature Reference DOI 10.1002/jhet.5570430428
Solvent CDCl3
Source File Reference UWSI67631