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1H-indole-1-acetic acid, 2,3-dihydro-3-hydroxy-3-[2-[4-(1-methylethyl)phenyl]-2-oxoethyl]-2-oxo-, ethyl ester
SpectraBase Compound ID JY1tvXj0Z3x
InChI InChI=1S/C23H25NO5/c1-4-29-21(26)14-24-19-8-6-5-7-18(19)23(28,22(24)27)13-20(25)17-11-9-16(10-12-17)15(2)3/h5-12,15,28H,4,13-14H2,1-3H3
InChIKey USCSROFIXFFGIX-UHFFFAOYSA-N
Mol Weight 395.46 g/mol
Molecular Formula C23H25NO5
Exact Mass 395.173273 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6X2tiFPOH1h
Name 1H-Indole-1-acetic acid, 2,3-dihydro-3-hydroxy-3-[2-[4-(1-methylethyl)phenyl]-2-oxoethyl]-2-oxo-, ethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 395.173272904 u
Formula C23H25NO5
InChI InChI=1S/C23H25NO5/c1-4-29-21(26)14-24-19-8-6-5-7-18(19)23(28,22(24)27)13-20(25)17-11-9-16(10-12-17)15(2)3/h5-12,15,28H,4,13-14H2,1-3H3
InChIKey USCSROFIXFFGIX-UHFFFAOYSA-N
Molecular Weight 395.455 g/mol
SMILES OC1(C(N(C2=C1C=CC=C2)CC(=O)OCC)=O)CC(C=1C=CC(=CC1)C(C)C)=O