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2-quinolinecarboxamide, N-[2-[[(5-bromo-2-furanyl)carbonyl]amino]ethyl]-
SpectraBase Compound ID GDZu5u4m8Wi
InChI InChI=1S/C17H14BrN3O3/c18-15-8-7-14(24-15)17(23)20-10-9-19-16(22)13-6-5-11-3-1-2-4-12(11)21-13/h1-8H,9-10H2,(H,19,22)(H,20,23)
InChIKey PKRAOAYOJVWOMI-UHFFFAOYSA-N
Mol Weight 388.22 g/mol
Molecular Formula C17H14BrN3O3
Exact Mass 387.021854 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lq9ptqfizQC
Name 2-Quinolinecarboxamide, N-[2-[[(5-bromo-2-furanyl)carbonyl]amino]ethyl]-
Comments Computed using HOSE algorithm
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Exact Mass 387.021854320 u
Formula C17H14BrN3O3
InChI InChI=1S/C17H14BrN3O3/c18-15-8-7-14(24-15)17(23)20-10-9-19-16(22)13-6-5-11-3-1-2-4-12(11)21-13/h1-8H,9-10H2,(H,19,22)(H,20,23)
InChIKey PKRAOAYOJVWOMI-UHFFFAOYSA-N
Molecular Weight 388.221 g/mol
SMILES N(C(C=1OC(Br)=CC1)=O)CCNC(C1=NC2=CC=CC=C2C=C1)=O