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1,3-Dioxolo[4,5-g]isoquinoline, 5-[[4-methoxy-3-(phenylmethoxy)phenyl]methyl]-
SpectraBase Compound ID 9aubCytwS9Z
InChI InChI=1S/C25H21NO4/c1-27-22-8-7-18(12-23(22)28-15-17-5-3-2-4-6-17)11-21-20-14-25-24(29-16-30-25)13-19(20)9-10-26-21/h2-10,12-14H,11,15-16H2,1H3
InChIKey GWDJJTHBFOOZPT-UHFFFAOYSA-N
Mol Weight 399.45 g/mol
Molecular Formula C25H21NO4
Exact Mass 399.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID PvL6HFXQPM
Name 1,3-Dioxolo[4,5-g]isoquinoline, 5-[[4-methoxy-3-(phenylmethoxy)phenyl]methyl]-
CAS Registry Number 38750-43-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H21NO4
InChI InChI=1S/C25H21NO4/c1-27-22-8-7-18(12-23(22)28-15-17-5-3-2-4-6-17)11-21-20-14-25-24(29-16-30-25)13-19(20)9-10-26-21/h2-10,12-14H,11,15-16H2,1H3
InChIKey GWDJJTHBFOOZPT-UHFFFAOYSA-N
Molecular Weight 399.446 g/mol
SMILES c12c(nccc2cc2OCOc2c1)Cc1cc(OCc2ccccc2)c(cc1)OC
SPLASH splash10-0a4l-4029000000-b750bbc152377ef59c06
Source of Spectrum B-42-211-3
Synonyms 5-[3-(benzyloxy)-4-methoxybenzyl][1,3]dioxolo[4,5-g]isoquinoline O-benzylisosevanine [5-{1,3}-dioxolo[4,5-g]isoquinolin-5-ylmethyl]-2-methoxy-1-benzyloxybenzene
Wiley ID 1369084