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3-(2-Chloro-6-fluorophenyl)-2-(3-pyridyl)-4-thiazolidinone
SpectraBase Compound ID FofpgmI1LIb
InChI InChI=1S/C14H10ClFN2OS/c15-10-4-1-5-11(16)13(10)18-12(19)8-20-14(18)9-3-2-6-17-7-9/h1-7,14H,8H2
InChIKey QMZRHBVGZOPUHG-UHFFFAOYSA-N
Mol Weight 308.76 g/mol
Molecular Formula C14H10ClFN2OS
Exact Mass 308.01864 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LvoTKWLUnAj
Name 3-(2-Chloro-6-fluorophenyl)-2-(3-pyridyl)-4-thiazolidinone
Comments Computed using HOSE algorithm
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Exact Mass 308.018639986 u
Formula C14H10ClFN2OS
InChI InChI=1S/C14H10ClFN2OS/c15-10-4-1-5-11(16)13(10)18-12(19)8-20-14(18)9-3-2-6-17-7-9/h1-7,14H,8H2
InChIKey QMZRHBVGZOPUHG-UHFFFAOYSA-N
Molecular Weight 308.758 g/mol
SMILES C=1C(=CN=CC1)C1SCC(N1C=1C(=CC=CC1Cl)F)=O