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Setigeridine
SpectraBase Compound ID 8KVes3fWW21
InChI InChI=1S/C20H19NO5/c1-22-16-8-12-6-7-21-19(14(12)10-17(16)23-2)20(24-3)13-4-5-15-18(9-13)26-11-25-15/h4-10,20H,11H2,1-3H3
InChIKey UZTFBGXIIOSHFC-UHFFFAOYSA-N
Mol Weight 353.37 g/mol
Molecular Formula C20H19NO5
Exact Mass 353.126323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6SiVrF4U23J
Name Setigeridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19NO5
InChI InChI=1S/C20H19NO5/c1-22-16-8-12-6-7-21-19(14(12)10-17(16)23-2)20(24-3)13-4-5-15-18(9-13)26-11-25-15/h4-10,20H,11H2,1-3H3
InChIKey UZTFBGXIIOSHFC-UHFFFAOYSA-N
Molecular Weight 353.374 g/mol
SMILES c1(c2cc(OC)c(cc2ccn1)OC)C(c1cc2OCOc2cc1)OC
SPLASH splash10-0g4i-0219000000-35055afa9f45f217bfae
Source of Spectrum G-61-1051-1
Synonyms 1-[(3',4'-Methylenedioxyphenyl)-(.alpha.-methoxy)methyl]-6,7-dimethoxyisoquinoline 1-[1,3-benzodioxol-5-yl(methoxy)methyl]-6,7-dimethoxyisoquinoline
Wiley ID 749161