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(E)-N-(2-iodo-4,5-dimethoxybenzyl)-2-(3-methoxyprop-1-enyl)-1Hpyrrole
SpectraBase Compound ID FbQQpY0u2Mr
InChI InChI=1S/C17H20INO3/c1-20-9-5-7-14-6-4-8-19(14)12-13-10-16(21-2)17(22-3)11-15(13)18/h4-8,10-11H,9,12H2,1-3H3/b7-5+
InChIKey OXVZEHPMURFVDI-FNORWQNLSA-N
Mol Weight 413.26 g/mol
Molecular Formula C17H20INO3
Exact Mass 413.048789 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FadWqzwBqW9
Name (E)-N-(2-iodo-4,5-dimethoxybenzyl)-2-(3-methoxyprop-1-enyl)-1Hpyrrole
Alternate Name(s) (E)-1-(2-iodo-4,5-dimethoxybenzyl)-2-(3-methoxyprop-1-en-1-yl)-1H-pyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20INO3
InChI InChI=1S/C17H20INO3/c1-20-9-5-7-14-6-4-8-19(14)12-13-10-16(21-2)17(22-3)11-15(13)18/h4-8,10-11H,9,12H2,1-3H3/b7-5+
InChIKey OXVZEHPMURFVDI-FNORWQNLSA-N
Literature Reference DOI 10.1002/adsc.200900368
Molecular Weight 413.255 g/mol
SMILES c1([n](ccc1)Cc1c(cc(c(c1)OC)OC)I)\C=C\COC
SPLASH splash10-004i-0190100000-d321076c454b801d3fd8
Source of Spectrum ASC-351-2460/SM7-3d
Wiley ID 1763439