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(R)-8-Methoxy-5-(4'-methoxyphenyl)-1,3-dimethyl-3,4-dihydroisoquinoline
SpectraBase Compound ID 76FqzTQ0c66
InChI InChI=1S/C19H21NO2/c1-12-11-17-16(14-5-7-15(21-3)8-6-14)9-10-18(22-4)19(17)13(2)20-12/h5-10,12H,11H2,1-4H3/t12-/m1/s1
InChIKey YTYUHCILBROQNR-GFCCVEGCSA-N
Mol Weight 295.38 g/mol
Molecular Formula C19H21NO2
Exact Mass 295.157229 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7KvmZ7kGzfC
Name (R)-8-Methoxy-5-(4'-methoxyphenyl)-1,3-dimethyl-3,4-dihydroisoquinoline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 295.157228918 u
Formula C19H21NO2
InChI InChI=1S/C19H21NO2/c1-12-11-17-16(14-5-7-15(21-3)8-6-14)9-10-18(22-4)19(17)13(2)20-12/h5-10,12H,11H2,1-4H3/t12-/m1/s1
InChIKey YTYUHCILBROQNR-GFCCVEGCSA-N
SMILES C1(=N[C@@](CC=2C(=CC=C(C12)OC)C=1C=CC(=CC1)OC)(C)[H])C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.821736