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Ethanone, 1-[4-[3-[4-[3-(4-acetylphenoxy)-2-hydroxypropyl]-1-piperazinyl]-2-hydroxypropoxy]phenyl]-
SpectraBase Compound ID 35vwEOBJJBF
InChI InChI=1S/C26H34N2O6/c1-19(29)21-3-7-25(8-4-21)33-17-23(31)15-27-11-13-28(14-12-27)16-24(32)18-34-26-9-5-22(6-10-26)20(2)30/h3-10,23-24,31-32H,11-18H2,1-2H3
InChIKey OAJPQFYTCQEFGQ-UHFFFAOYSA-N
Mol Weight 470.6 g/mol
Molecular Formula C26H34N2O6
Exact Mass 470.241687 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HK5FtllAzD8
Name Ethanone, 1-[4-[3-[4-[3-(4-acetylphenoxy)-2-hydroxypropyl]-1-piperazinyl]-2-hydroxypropoxy]phenyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 470.241686817 u
Formula C26H34N2O6
InChI InChI=1S/C26H34N2O6/c1-19(29)21-3-7-25(8-4-21)33-17-23(31)15-27-11-13-28(14-12-27)16-24(32)18-34-26-9-5-22(6-10-26)20(2)30/h3-10,23-24,31-32H,11-18H2,1-2H3
InChIKey OAJPQFYTCQEFGQ-UHFFFAOYSA-N
Molecular Weight 470.566 g/mol
SMILES OC(CN1CCN(CC(COC2=CC=C(C(=O)C)C=C2)O)CC1)COC=1C=CC(C(=O)C)=CC1