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1H-indole-3-propanoic acid, alpha~3~-[(ethyloxidanyl)oxidanylidenemethyl]-2-methyl-, ethyl ester

View entire compound with spectra: 2 NMR

1H-indole-3-propanoic acid, alpha~3~-[(ethyloxidanyl)oxidanylidenemethyl]-2-methyl-, ethyl ester
SpectraBase Compound ID ENV0uUqYwIs
InChI InChI=1S/C17H21NO4/c1-4-21-16(19)14(17(20)22-5-2)10-13-11(3)18-15-9-7-6-8-12(13)15/h6-9,14,18H,4-5,10H2,1-3H3
InChIKey SDGHKFATACOZPG-UHFFFAOYSA-N
Mol Weight 303.36 g/mol
Molecular Formula C17H21NO4
Exact Mass 303.147058 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G1IZH3xYJwe
Name 1H-Indole-3-propanoic acid, alpha~3~-[(ethyloxidanyl)oxidanylidenemethyl]-2-methyl-, ethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 303.147058156 u
Formula C17H21NO4
InChI InChI=1S/C17H21NO4/c1-4-21-16(19)14(17(20)22-5-2)10-13-11(3)18-15-9-7-6-8-12(13)15/h6-9,14,18H,4-5,10H2,1-3H3
InChIKey SDGHKFATACOZPG-UHFFFAOYSA-N
SMILES N1C2=C(C(=C1C)CC(C(=O)OCC)C(=O)OCC)C=CC=C2