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(1R,3S)-2-Benzyl-6,8-dimethoxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinoline
SpectraBase Compound ID 9NTi7mFdIGk
InChI InChI=1S/C20H25NO2/c1-14-10-17-11-18(22-3)12-19(23-4)20(17)15(2)21(14)13-16-8-6-5-7-9-16/h5-9,11-12,14-15H,10,13H2,1-4H3/t14-,15+/m0/s1
InChIKey RGYCJCNJSUCUCI-LSDHHAIUSA-N
Mol Weight 311.43 g/mol
Molecular Formula C20H25NO2
Exact Mass 311.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1ySe3cMhbE
Name (1R,3S)-2-Benzyl-6,8-dimethoxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinoline
Appearance Colorless oil
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Formula C20H25NO2
InChI InChI=1S/C20H25NO2/c1-14-10-17-11-18(22-3)12-19(23-4)20(17)15(2)21(14)13-16-8-6-5-7-9-16/h5-9,11-12,14-15H,10,13H2,1-4H3/t14-,15+/m0/s1
InChIKey RGYCJCNJSUCUCI-LSDHHAIUSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201600701
Optical Rotation [a]D20 = +45.4 (c = 0.11, CH2Cl2)
Quality 82
Reported Formula C20H25NO2
SMILES C1(=CC=CC=C1)CN1[C@@](C2=C(C[C@@]1(C)[H])C=C(C=C2OC)OC)(C)[H]
SPLASH splash10-0002-3190000000-5c692ebd0fc9e6ffe557
Source of Spectrum QE-22-SM8-15 (DOI: 10.1002/chem.201600701)
Wiley ID 1904907