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3-Pyridinecarboxamide, N-[5-phenyl-4-(trifluoromethyl)-2-thiazolyl]-
SpectraBase Compound ID 8od5ET4PcIa
InChI InChI=1S/C16H10F3N3OS/c17-16(18,19)13-12(10-5-2-1-3-6-10)24-15(21-13)22-14(23)11-7-4-8-20-9-11/h1-9H,(H,21,22,23)
InChIKey AZXWOEKJGXKDTF-UHFFFAOYSA-N
Mol Weight 349.33 g/mol
Molecular Formula C16H10F3N3OS
Exact Mass 349.049668 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LwNNwBMOVsP
Name 3-Pyridinecarboxamide, N-[5-phenyl-4-(trifluoromethyl)-2-thiazolyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 349.049667616 u
Formula C16H10F3N3OS
InChI InChI=1S/C16H10F3N3OS/c17-16(18,19)13-12(10-5-2-1-3-6-10)24-15(21-13)22-14(23)11-7-4-8-20-9-11/h1-9H,(H,21,22,23)
InChIKey AZXWOEKJGXKDTF-UHFFFAOYSA-N
Molecular Weight 349.331 g/mol
SMILES C1(=C(SC(=N1)NC(C1=CN=CC=C1)=O)C=1C=CC=CC1)C(F)(F)F