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3-[2-(3-Acetamidoanilino)ethylcarbamoyl]coumarin

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

3-[2-(3-Acetamidoanilino)ethylcarbamoyl]coumarin
SpectraBase Compound ID IDrXFthvo21
InChI InChI=1S/C20H19N3O4/c1-13(24)23-16-7-4-6-15(12-16)21-9-10-22-19(25)17-11-14-5-2-3-8-18(14)27-20(17)26/h2-8,11-12,21H,9-10H2,1H3,(H,22,25)(H,23,24)
InChIKey RLDNQPWCNFODAF-UHFFFAOYSA-N
Mol Weight 365.39 g/mol
Molecular Formula C20H19N3O4
Exact Mass 365.137556 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JZgYPTzyR99
Name 3-[2-(3-Acetamidoanilino)ethylcarbamoyl]coumarin
Comments Computed using HOSE algorithm
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Exact Mass 365.137556100 u
Formula C20H19N3O4
InChI InChI=1S/C20H19N3O4/c1-13(24)23-16-7-4-6-15(12-16)21-9-10-22-19(25)17-11-14-5-2-3-8-18(14)27-20(17)26/h2-8,11-12,21H,9-10H2,1H3,(H,22,25)(H,23,24)
InChIKey RLDNQPWCNFODAF-UHFFFAOYSA-N
Molecular Weight 365.389 g/mol
SMILES C12=C(C=CC=C2)C=C(C(O1)=O)C(NCCNC1=CC(=CC=C1)NC(C)=O)=O