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(S)-(-)-3-(3,4-Dimethoxyphenyl)-N-(2,2-dimethoxyethyl)-1,2,3,4-tetrahydroisoquinoline
SpectraBase Compound ID JCwxxLv2ADT
InChI InChI=1S/C21H27NO4/c1-23-19-10-9-16(12-20(19)24-2)18-11-15-7-5-6-8-17(15)13-22(18)14-21(25-3)26-4/h5-10,12,18,21H,11,13-14H2,1-4H3/t18-/m0/s1
InChIKey JFEUAOJYSYBNJE-SFHVURJKSA-N
Mol Weight 357.45 g/mol
Molecular Formula C21H27NO4
Exact Mass 357.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3mLSEWGPwy5
Name (S)-(-)-3-(3,4-Dimethoxyphenyl)-N-(2,2-dimethoxyethyl)-1,2,3,4-tetrahydroisoquinoline
Alternate Name(s) (3S)-2-(2,2-dimethoxyethyl)-3-(3,4-dimethoxyphenyl)-1,2,3,4-tetrahydroisoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27NO4
InChI InChI=1S/C21H27NO4/c1-23-19-10-9-16(12-20(19)24-2)18-11-15-7-5-6-8-17(15)13-22(18)14-21(25-3)26-4/h5-10,12,18,21H,11,13-14H2,1-4H3/t18-/m0/s1
InChIKey JFEUAOJYSYBNJE-SFHVURJKSA-N
Molecular Weight 357.450 g/mol
SMILES [C@]1(N(Cc2c(C1)cccc2)CC(OC)OC)(c1cc(OC)c(cc1)OC)[H]
SPLASH splash10-001i-0190000000-d381c164f3fc9708896c
Source of Spectrum KD-16-2957-9
Wiley ID 1637944