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4-Phenyl-2-[5-(trifluoromethyl)-1-pyrazolyl]thiazole
SpectraBase Compound ID EeEmCcz7gfP
InChI InChI=1S/C13H8F3N3S/c14-13(15,16)11-6-7-17-19(11)12-18-10(8-20-12)9-4-2-1-3-5-9/h1-8H
InChIKey ZEQFBUXSVYPGKT-UHFFFAOYSA-N
Mol Weight 295.28 g/mol
Molecular Formula C13H8F3N3S
Exact Mass 295.039103 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Br00gy3DijW
Name 4-Phenyl-2-[5-(trifluoromethyl)-1-pyrazolyl]thiazole
Comments Computed using HOSE algorithm
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Exact Mass 295.039102933 u
Formula C13H8F3N3S
InChI InChI=1S/C13H8F3N3S/c14-13(15,16)11-6-7-17-19(11)12-18-10(8-20-12)9-4-2-1-3-5-9/h1-8H
InChIKey ZEQFBUXSVYPGKT-UHFFFAOYSA-N
Molecular Weight 295.283 g/mol
SMILES C1(N2C(C(F)(F)F)=CC=N2)=NC(C2=CC=CC=C2)=CS1