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1,3-Dioxolo[4,5-g]isoquinoline, 5,6,7,8-tetrahydro-6-(6-iodo-2,3-dimethoxybenzoyl)-5-methylene-
SpectraBase Compound ID LNBSP0XbCkR
InChI InChI=1S/C20H18INO5/c1-11-13-9-17-16(26-10-27-17)8-12(13)6-7-22(11)20(23)18-14(21)4-5-15(24-2)19(18)25-3/h4-5,8-9H,1,6-7,10H2,2-3H3
InChIKey JDSSMORMHMCUNQ-UHFFFAOYSA-N
Mol Weight 479.27 g/mol
Molecular Formula C20H18INO5
Exact Mass 479.022968 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9v3EmgmoA1E
Name 1,3-Dioxolo[4,5-g]isoquinoline, 5,6,7,8-tetrahydro-6-(6-iodo-2,3-dimethoxybenzoyl)-5-methylene-
CAS Registry Number 130259-86-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18INO5
InChI InChI=1S/C20H18INO5/c1-11-13-9-17-16(26-10-27-17)8-12(13)6-7-22(11)20(23)18-14(21)4-5-15(24-2)19(18)25-3/h4-5,8-9H,1,6-7,10H2,2-3H3
InChIKey JDSSMORMHMCUNQ-UHFFFAOYSA-N
Molecular Weight 479.270 g/mol
SMILES C(N1C(c2cc3OCOc3cc2CC1)=C)(c1c(c(OC)ccc1I)OC)=O
SPLASH splash10-0fdk-0025900000-719b62a800beffcb2a16
Source of Spectrum F-46-4012-28
Synonyms 1-Methylidene-2-(2,3-dimethoxy-6-iodobenzoyl)-6,7-methylenedioxy-1,2,3,4-tetrahydroisoquinoline 6-(6-iodo-2,3-dimethoxybenzoyl)-5-methylene-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinoline
Wiley ID 1394952