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1-[[1-(3,4-Dimethoxyphenyl)ethyl](methyl)amino]-3-phenoxy-2-propanol
SpectraBase Compound ID H39gZ8sdxOa
InChI InChI=1S/C20H27NO4/c1-15(16-10-11-19(23-3)20(12-16)24-4)21(2)13-17(22)14-25-18-8-6-5-7-9-18/h5-12,15,17,22H,13-14H2,1-4H3
InChIKey AEIUWQDLXBBSPS-UHFFFAOYSA-N
Mol Weight 345.44 g/mol
Molecular Formula C20H27NO4
Exact Mass 345.194008 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9aQANjVFBnU
Name 1-[[1-(3,4-Dimethoxyphenyl)ethyl](methyl)amino]-3-phenoxy-2-propanol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 345.194008349 u
Formula C20H27NO4
InChI InChI=1S/C20H27NO4/c1-15(16-10-11-19(23-3)20(12-16)24-4)21(2)13-17(22)14-25-18-8-6-5-7-9-18/h5-12,15,17,22H,13-14H2,1-4H3
InChIKey AEIUWQDLXBBSPS-UHFFFAOYSA-N
Molecular Weight 345.439 g/mol
SMILES C=1C=CC(OCC(CN(C(C=2C=C(OC)C(=CC2)OC)C)C)O)=CC1