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(E)-But-2-enoic acid [3-((E)-2-furan-2-yl-vinyl)-4-methyl-quinolin-2-yl]-amide
SpectraBase Compound ID 9Xj3DRytTrO
InChI InChI=1S/C20H18N2O2/c1-3-7-19(23)22-20-17(12-11-15-8-6-13-24-15)14(2)16-9-4-5-10-18(16)21-20/h3-13H,1-2H3,(H,21,22,23)/b7-3+,12-11+
InChIKey OOLNGFVBWXYWBU-SOHFFQIYSA-N
Mol Weight 318.38 g/mol
Molecular Formula C20H18N2O2
Exact Mass 318.136828 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CYeP9bt6F8V
Name (E)-but-2-Enoic acid [3-((E)-2-furan-2-yl-vinyl)-4-methyl-quinolin-2-yl]-amide
Comments Computed using HOSE algorithm
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Exact Mass 318.136827826 u
Formula C20H18N2O2
InChI InChI=1S/C20H18N2O2/c1-3-7-19(23)22-20-17(12-11-15-8-6-13-24-15)14(2)16-9-4-5-10-18(16)21-20/h3-13H,1-2H3,(H,21,22,23)/b7-3+,12-11+
InChIKey OOLNGFVBWXYWBU-SOHFFQIYSA-N
Molecular Weight 318.376 g/mol
SMILES C=1(N=C2C=CC=CC2=C(C1\C=C\C=1OC=CC1)C)NC(\C=C\C)=O