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(E)-benzyl 3-[1-(2-iodo-4,5-dimethoxybenzyl)-1H-pyrrol-2-yl]acrylate
SpectraBase Compound ID 9qWAhQs9bfD
InChI InChI=1S/C23H22INO4/c1-27-21-13-18(20(24)14-22(21)28-2)15-25-12-6-9-19(25)10-11-23(26)29-16-17-7-4-3-5-8-17/h3-14H,15-16H2,1-2H3/b11-10+
InChIKey JZCFTSJLJLBZOB-ZHACJKMWSA-N
Mol Weight 503.34 g/mol
Molecular Formula C23H22INO4
Exact Mass 503.059353 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DSqLjBUf8lf
Name (E)-benzyl 3-[1-(2-iodo-4,5-dimethoxybenzyl)-1H-pyrrol-2-yl]acrylate
Alternate Name(s) (E)-benzyl 3-(1-(2-iodo-4,5-dimethoxybenzyl)-1H-pyrrol-2-yl)acrylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H22INO4
InChI InChI=1S/C23H22INO4/c1-27-21-13-18(20(24)14-22(21)28-2)15-25-12-6-9-19(25)10-11-23(26)29-16-17-7-4-3-5-8-17/h3-14H,15-16H2,1-2H3/b11-10+
InChIKey JZCFTSJLJLBZOB-ZHACJKMWSA-N
Literature Reference DOI 10.1002/adsc.200900368
Molecular Weight 503.336 g/mol
SMILES C(\C=C\c1[n](ccc1)Cc1c(cc(c(c1)OC)OC)I)(=O)OCc1ccccc1
SPLASH splash10-004i-1191010000-6fd048831d6952bc47ea
Source of Spectrum ASC-351-2460/SM3-3a
Wiley ID 1763436