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1-(2-Iodo-4,5-methylenedioxybenzyl)pyrrole-2-carboxylic acid diethyl amide
SpectraBase Compound ID IvxmICA4w7S
InChI InChI=1S/C17H19IN2O3/c1-3-19(4-2)17(21)14-6-5-7-20(14)10-12-8-15-16(9-13(12)18)23-11-22-15/h5-9H,3-4,10-11H2,1-2H3
InChIKey FWGAWMDRHMABEE-UHFFFAOYSA-N
Mol Weight 426.25 g/mol
Molecular Formula C17H19IN2O3
Exact Mass 426.044037 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JoHy4mTBTgP
Name 1-(2-Iodo-4,5-methylenedioxybenzyl)pyrrole-2-carboxylic acid diethyl amide
Comments Removed - expert review: solvent contamination (chloroform)); A corrected record has been addded having SpectrumID: 1718270
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19IN2O3
InChI InChI=1S/C17H19IN2O3/c1-3-19(4-2)17(21)14-6-5-7-20(14)10-12-8-15-16(9-13(12)18)23-11-22-15/h5-9H,3-4,10-11H2,1-2H3
InChIKey FWGAWMDRHMABEE-UHFFFAOYSA-N
Molecular Weight 426.254 g/mol
SMILES c1([n](ccc1)Cc1c(cc2c(c1)OCO2)I)C(N(CC)CC)=O
SPLASH splash10-001r-9040000000-cb042a9cf0062ae6c7a9
Source of Spectrum KC-61-3317-5
Synonyms N,N-diethyl-1-[(6-iodo-1,3-benzodioxol-5-yl)methyl]-1H-pyrrole-2-carboxamide
Wiley ID 1628470