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2-(4-Chloroanilino)-4H-pyrido[3,2-E][1,3]thiazin-4-one
SpectraBase Compound ID 26hH8C2hBDP
InChI InChI=1S/C13H8ClN3OS/c14-8-3-5-9(6-4-8)16-13-17-11(18)10-2-1-7-15-12(10)19-13/h1-7H,(H,16,17,18)
InChIKey ARCRSKORASYYDV-UHFFFAOYSA-N
Mol Weight 289.74 g/mol
Molecular Formula C13H8ClN3OS
Exact Mass 289.007661 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID WKCGpZqOUK
Name 2-(4-Chloroanilino)-4H-pyrido[3,2-E][1,3]thiazin-4-one
Comments Computed using HOSE algorithm
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Exact Mass 289.007660763 u
Formula C13H8ClN3OS
InChI InChI=1S/C13H8ClN3OS/c14-8-3-5-9(6-4-8)16-13-17-11(18)10-2-1-7-15-12(10)19-13/h1-7H,(H,16,17,18)
InChIKey ARCRSKORASYYDV-UHFFFAOYSA-N
SMILES C1=2SC(=NC(C1=CC=CN2)=O)NC1=CC=C(C=C1)Cl