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1,2,3,4-Tetrahydro-2-(2-hydroxy-3-phenoxypropyl)-6,7-dimethoxyisoquinoline
SpectraBase Compound ID C2PaUnR20tt
InChI InChI=1S/C20H25NO4/c1-23-19-10-15-8-9-21(12-16(15)11-20(19)24-2)13-17(22)14-25-18-6-4-3-5-7-18/h3-7,10-11,17,22H,8-9,12-14H2,1-2H3
InChIKey KUYHKHWEQQKGIQ-UHFFFAOYSA-N
Mol Weight 343.42 g/mol
Molecular Formula C20H25NO4
Exact Mass 343.178358 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fre7izGwECp
Name 1,2,3,4-Tetrahydro-2-(2-hydroxy-3-phenoxypropyl)-6,7-dimethoxyisoquinoline
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 343.178358285 u
Formula C20H25NO4
InChI InChI=1S/C20H25NO4/c1-23-19-10-15-8-9-21(12-16(15)11-20(19)24-2)13-17(22)14-25-18-6-4-3-5-7-18/h3-7,10-11,17,22H,8-9,12-14H2,1-2H3
InChIKey KUYHKHWEQQKGIQ-UHFFFAOYSA-N
Molecular Weight 343.423 g/mol
SMILES C1=CC=C(C=C1)OCC(CN1CC2=CC(OC)=C(C=C2CC1)OC)O