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(2E)-3-{1-[2-(4-methylphenoxy)ethyl]-1H-indol-3-yl}-2-propenoic acid

View entire compound with spectra: 3 NMR

(2E)-3-{1-[2-(4-methylphenoxy)ethyl]-1H-indol-3-yl}-2-propenoic acid
SpectraBase Compound ID 2ZYdHWdEc2l
InChI InChI=1S/C20H19NO3/c1-15-6-9-17(10-7-15)24-13-12-21-14-16(8-11-20(22)23)18-4-2-3-5-19(18)21/h2-11,14H,12-13H2,1H3,(H,22,23)/b11-8+
InChIKey HNRQHXNEKIVLTR-DHZHZOJOSA-N
Mol Weight 321.38 g/mol
Molecular Formula C20H19NO3
Exact Mass 321.136493 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID sgxgKpmxIX
Name (2E)-3-{1-[2-(4-Methylphenoxy)ethyl]-1H-indol-3-yl}-2-propenoic acid
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 321.136493473 u
Formula C20H19NO3
InChI InChI=1S/C20H19NO3/c1-15-6-9-17(10-7-15)24-13-12-21-14-16(8-11-20(22)23)18-4-2-3-5-19(18)21/h2-11,14H,12-13H2,1H3,(H,22,23)/b11-8+
InChIKey HNRQHXNEKIVLTR-DHZHZOJOSA-N
Molecular Weight 321.376 g/mol
SMILES OC(\C=C\C1=CN(C=2C1=CC=CC2)CCOC=1C=CC(=CC1)C)=O