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1-(4-METHYLPHENYL)-4-1-TRIFLUOROMETHYL-2,3-DIHYDRO-1-H-PYRIMIDO-[6.1-B]-[1.3]-BENZOTHIAZOL-3-ONE
SpectraBase Compound ID 8OReaiUvfpV
InChI InChI=1S/C19H12F3N3OS/c1-11-6-8-12(9-7-11)18(19(20,21)22)24-16(26)13(10-23)17-25(18)14-4-2-3-5-15(14)27-17/h2-9H,1H3,(H,24,26)
InChIKey SHZDZFPCRMJZBZ-UHFFFAOYSA-N
Mol Weight 387.38 g/mol
Molecular Formula C19H12F3N3OS
Exact Mass 387.065318 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HrTgpFau1tP
Name 1-(4-METHYLPHENYL)-4-1-TRIFLUOROMETHYL-2,3-DIHYDRO-1-H-PYRIMIDO-[6.1-B]-[1.3]-BENZOTHIAZOL-3-ONE
Compound Number IV-B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H12F3N3OS
InChI InChI=1S/C19H12F3N3OS/c1-11-6-8-12(9-7-11)18(19(20,21)22)24-16(26)13(10-23)17-25(18)14-4-2-3-5-15(14)27-17/h2-9H,1H3,(H,24,26)
InChIKey SHZDZFPCRMJZBZ-UHFFFAOYSA-N
Literature Reference Author M.V.VOVL,P.S.LEBED,V.A.SUKACH,M.Y.KORNILOV
Literature Reference Citation RUSS.J.ORG.CHEM.,39,1781(2003)
Literature Reference DOI 10.1023/B:RUJO.0000019744.08100.85
Solvent CDCl3
Source File Reference UWMZ18719