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ethyl 1-(4-chlorophenyl)-5-hydroxy-2-methyl-1H-indole-3-carboxylate

View entire compound with spectra: 2 NMR

ethyl 1-(4-chlorophenyl)-5-hydroxy-2-methyl-1H-indole-3-carboxylate
SpectraBase Compound ID 4SZZHcQC6VT
InChI InChI=1S/C18H16ClNO3/c1-3-23-18(22)17-11(2)20(13-6-4-12(19)5-7-13)16-9-8-14(21)10-15(16)17/h4-10,21H,3H2,1-2H3
InChIKey YLFJOTVIDFVLRZ-UHFFFAOYSA-N
Mol Weight 329.78 g/mol
Molecular Formula C18H16ClNO3
Exact Mass 329.081871 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D47C3NDDVFJ
Name Ethyl 1-(4-chlorophenyl)-5-hydroxy-2-methyl-1H-indole-3-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 329.081871076 u
Formula C18H16ClNO3
InChI InChI=1S/C18H16ClNO3/c1-3-23-18(22)17-11(2)20(13-6-4-12(19)5-7-13)16-9-8-14(21)10-15(16)17/h4-10,21H,3H2,1-2H3
InChIKey YLFJOTVIDFVLRZ-UHFFFAOYSA-N
Molecular Weight 329.783 g/mol
SMILES OC1=CC=2C(=C(N(C=3C=CC(=CC3)Cl)C2C=C1)C)C(=O)OCC