3-[2-(4-tert-butylphenyl)-2-keto-ethyl]-1-[(E)-cinnamyl]-3-hydroxy-oxindole

SpectraBase Compound ID	LyOWqDScbFn
InChI	InChI=1S/C29H29NO3/c1-28(2,3)23-17-15-22(16-18-23)26(31)20-29(33)24-13-7-8-14-25(24)30(27(29)32)19-9-12-21-10-5-4-6-11-21/h4-18,33H,19-20H2,1-3H3/b12-9+
InChIKey	NMDJVHPNSFOFAP-FMIVXFBMSA-N Google Search
Mol Weight	439.56 g/mol
Molecular Formula	C29H29NO3
Exact Mass	439.214744 g/mol

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SpectraBase Spectrum ID	H74MGTnHmpK
Name	3-[2-(4-Tert-butylphenyl)-2-keto-ethyl]-1-[(E)-cinnamyl]-3-hydroxy-oxindole
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	439.214743795 u
Formula	C29H29NO3
InChI	InChI=1S/C29H29NO3/c1-28(2,3)23-17-15-22(16-18-23)26(31)20-29(33)24-13-7-8-14-25(24)30(27(29)32)19-9-12-21-10-5-4-6-11-21/h4-18,33H,19-20H2,1-3H3/b12-9+
InChIKey	NMDJVHPNSFOFAP-FMIVXFBMSA-N
Molecular Weight	439.555 g/mol
SMILES	C1=C2C(=CC=C1)C(C(N2C\C=C\C=1C=CC=CC1)=O)(CC(=O)C1=CC=C(C=C1)C(C)(C)C)O