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2-(4-methylphenoxy)-N-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]acetamide
SpectraBase Compound ID F98FLZpIM7Z
InChI InChI=1S/C21H16N2O4S/c1-13-6-8-15(9-7-13)26-11-19(24)23-21-22-17(12-28-21)16-10-14-4-2-3-5-18(14)27-20(16)25/h2-10,12H,11H2,1H3,(H,22,23,24)
InChIKey COVBNFCMBNDXQO-UHFFFAOYSA-N
Mol Weight 392.43 g/mol
Molecular Formula C21H16N2O4S
Exact Mass 392.083078 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LOGgTGxYyOA
Name 2-(4-Methylphenoxy)-N-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]acetamide
Comments Computed using HOSE algorithm
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Exact Mass 392.083078173 u
Formula C21H16N2O4S
InChI InChI=1S/C21H16N2O4S/c1-13-6-8-15(9-7-13)26-11-19(24)23-21-22-17(12-28-21)16-10-14-4-2-3-5-18(14)27-20(16)25/h2-10,12H,11H2,1H3,(H,22,23,24)
InChIKey COVBNFCMBNDXQO-UHFFFAOYSA-N
Molecular Weight 392.429 g/mol
SMILES N(C1=NC(C=2C(OC=3C(C2)=CC=CC3)=O)=CS1)C(=O)COC1=CC=C(C=C1)C