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1-[2-(1H-indol-3-yl)ethyl]-3-(2-oxidanylidenepropyl)piperidin-2-one
SpectraBase Compound ID xDH2FUuARA
InChI InChI=1S/C18H22N2O2/c1-13(21)11-14-5-4-9-20(18(14)22)10-8-15-12-19-17-7-3-2-6-16(15)17/h2-3,6-7,12,14,19H,4-5,8-11H2,1H3
InChIKey ZPZBWABSVBRHIY-UHFFFAOYSA-N
Mol Weight 298.39 g/mol
Molecular Formula C18H22N2O2
Exact Mass 298.168128 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FArDh4kKpeR
Name 1-[2-(1H-Indol-3-yl)ethyl]-3-(2-oxidanylidenepropyl)piperidin-2-one
Comments Computed using HOSE algorithm
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Exact Mass 298.168127954 u
Formula C18H22N2O2
InChI InChI=1S/C18H22N2O2/c1-13(21)11-14-5-4-9-20(18(14)22)10-8-15-12-19-17-7-3-2-6-16(15)17/h2-3,6-7,12,14,19H,4-5,8-11H2,1H3
InChIKey ZPZBWABSVBRHIY-UHFFFAOYSA-N
SMILES C1(N(CCC2=CNC3=C2C=CC=C3)CCCC1CC(=O)C)=O