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2-[2-(2-Methoxyphenyl)ethyl]-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one
SpectraBase Compound ID 3C5H04Nu1Dg
InChI InChI=1S/C20H20N2O2/c1-24-18-9-5-2-6-14(18)10-12-22-13-11-16-15-7-3-4-8-17(15)21-19(16)20(22)23/h2-9,21H,10-13H2,1H3
InChIKey FHBFWWFJMRNZOC-UHFFFAOYSA-N
Mol Weight 320.39 g/mol
Molecular Formula C20H20N2O2
Exact Mass 320.152478 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C79RB55ffl5
Name 2-[2-(2-Methoxyphenyl)ethyl]-2,3,4,9-tetrahydropyrido[3,4-B]indol-1-one
Comments Computed using HOSE algorithm
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Exact Mass 320.152477890 u
Formula C20H20N2O2
InChI InChI=1S/C20H20N2O2/c1-24-18-9-5-2-6-14(18)10-12-22-13-11-16-15-7-3-4-8-17(15)21-19(16)20(22)23/h2-9,21H,10-13H2,1H3
InChIKey FHBFWWFJMRNZOC-UHFFFAOYSA-N
Molecular Weight 320.392 g/mol
SMILES C12=C(C=3C=CC=CC3N2)CCN(C1=O)CCC=1C(OC)=CC=CC1