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1-[(3,4-diethoxyphenyl)methyl]-6,7-di(propan-2-yloxy)isoquinoline
SpectraBase Compound ID I3S8zzhLO0K
InChI InChI=1S/C26H33NO4/c1-7-28-23-10-9-19(14-24(23)29-8-2)13-22-21-16-26(31-18(5)6)25(30-17(3)4)15-20(21)11-12-27-22/h9-12,14-18H,7-8,13H2,1-6H3
InChIKey OUYDQUYVGBGFKZ-UHFFFAOYSA-N
Mol Weight 423.6 g/mol
Molecular Formula C26H33NO4
Exact Mass 423.240959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EF1NurvF7z9
Name 1-[(3,4-diethoxyphenyl)methyl]-6,7-di(propan-2-yloxy)isoquinoline
Alternate Name(s) 1-[(3,4-diethoxyphenyl)methyl]-6,7-diisopropoxy-isoquinoline
CAS Registry Number 68490-00-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H33NO4
InChI InChI=1S/C26H33NO4/c1-7-28-23-10-9-19(14-24(23)29-8-2)13-22-21-16-26(31-18(5)6)25(30-17(3)4)15-20(21)11-12-27-22/h9-12,14-18H,7-8,13H2,1-6H3
InChIKey OUYDQUYVGBGFKZ-UHFFFAOYSA-N
Molecular Weight 423.553 g/mol
SMILES CCOc1ccc(cc1OCC)Cc1c2cc(c(cc2ccn1)OC(C)C)OC(C)C
SPLASH splash10-00e9-0149400000-a6d9c320bb7b14b13f7e
Source of Spectrum O-24-314-0
Wiley ID 1378994