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Ethyl 2-[(6',7'-dimethoxy-1'-isoquinolyl)methyl]benzoate
SpectraBase Compound ID 7m9MpQuMVh9
InChI InChI=1S/C21H21NO4/c1-4-26-21(23)16-8-6-5-7-14(16)11-18-17-13-20(25-3)19(24-2)12-15(17)9-10-22-18/h5-10,12-13H,4,11H2,1-3H3
InChIKey UTRJQKJGAFXOQJ-UHFFFAOYSA-N
Mol Weight 351.4 g/mol
Molecular Formula C21H21NO4
Exact Mass 351.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LHyUmnW39op
Name Ethyl 2-[(6',7'-dimethoxy-1'-isoquinolyl)methyl]benzoate
Alternate Name(s) Ethyl 2-[(6,7-dimethoxy-1-isoquinolinyl)methyl]benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO4
InChI InChI=1S/C21H21NO4/c1-4-26-21(23)16-8-6-5-7-14(16)11-18-17-13-20(25-3)19(24-2)12-15(17)9-10-22-18/h5-10,12-13H,4,11H2,1-3H3
InChIKey UTRJQKJGAFXOQJ-UHFFFAOYSA-N
Molecular Weight 351.402 g/mol
SMILES c12c(Cc3c(C(=O)OCC)cccc3)nccc1cc(OC)c(c2)OC
SPLASH splash10-0zi0-0029000000-9d2c4dd697ba0b0945d1
Source of Spectrum AH-131-79-6
Wiley ID 770866