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2H-1-benzopyran-3-propanamide, N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-methyl-7-[(2-methyl-2-propenyl)oxy]-2-oxo-
SpectraBase Compound ID H8GoZzqfMjF
InChI InChI=1S/C28H30N2O5/c1-17(2)16-34-21-5-7-22-18(3)23(28(32)35-26(22)14-21)8-10-27(31)29-12-11-19-15-30-25-9-6-20(33-4)13-24(19)25/h5-7,9,13-15,30H,1,8,10-12,16H2,2-4H3,(H,29,31)
InChIKey XKGCICYXWJWGSL-UHFFFAOYSA-N
Mol Weight 474.56 g/mol
Molecular Formula C28H30N2O5
Exact Mass 474.215472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1GYci3cgbA3
Name 2H-1-Benzopyran-3-propanamide, N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-methyl-7-[(2-methyl-2-propenyl)oxy]-2-oxo-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 474.215472069 u
Formula C28H30N2O5
InChI InChI=1S/C28H30N2O5/c1-17(2)16-34-21-5-7-22-18(3)23(28(32)35-26(22)14-21)8-10-27(31)29-12-11-19-15-30-25-9-6-20(33-4)13-24(19)25/h5-7,9,13-15,30H,1,8,10-12,16H2,2-4H3,(H,29,31)
InChIKey XKGCICYXWJWGSL-UHFFFAOYSA-N
Molecular Weight 474.557 g/mol
SMILES N(C(CCC=1C(OC=2C(C1C)=CC=C(OCC(=C)C)C2)=O)=O)CCC1=CNC=2C1=CC(=CC2)OC