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(E)-Ethyl 3-(2-phenylindol-3-yl)prop-2-enoate
SpectraBase Compound ID 3MAKkjel6Fc
InChI InChI=1S/C19H17NO2/c1-2-22-18(21)13-12-16-15-10-6-7-11-17(15)20-19(16)14-8-4-3-5-9-14/h3-13,20H,2H2,1H3/b13-12+
InChIKey SNGZGQLRNGHEQX-OUKQBFOZSA-N
Mol Weight 291.35 g/mol
Molecular Formula C19H17NO2
Exact Mass 291.125929 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HzuXa5LbzSA
Name (E)-Ethyl 3-(2-phenylindol-3-yl)prop-2-enoate
Comments Computed using HOSE algorithm
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Exact Mass 291.125928789 u
Formula C19H17NO2
InChI InChI=1S/C19H17NO2/c1-2-22-18(21)13-12-16-15-10-6-7-11-17(15)20-19(16)14-8-4-3-5-9-14/h3-13,20H,2H2,1H3/b13-12+
InChIKey SNGZGQLRNGHEQX-OUKQBFOZSA-N
SMILES C1(=C(\C=C\C(=O)OCC)C=2C=CC=CC2N1)C=1C=CC=CC1