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Ethyl-2,4-dichloro-6-(4-(ethoxycarbonyl)phenyl)-3-iodo-1-(methoxymethyl)-1Hpyrrolo[2,3-b]pyridine-5-carboxylate
SpectraBase Compound ID 9NDtkYvdWvk
InChI InChI=1S/C21H19Cl2IN2O5/c1-4-30-20(27)12-8-6-11(7-9-12)17-14(21(28)31-5-2)15(22)13-16(24)18(23)26(10-29-3)19(13)25-17/h6-9H,4-5,10H2,1-3H3
InChIKey YKOYTLBRLLBAIB-UHFFFAOYSA-N
Mol Weight 577.2 g/mol
Molecular Formula C21H19Cl2IN2O5
Exact Mass 575.971572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5y0lb0P4dRP
Name Ethyl-2,4-dichloro-6-(4-(ethoxycarbonyl)phenyl)-3-iodo-1-(methoxymethyl)-1Hpyrrolo[2,3-b]pyridine-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19Cl2IN2O5
InChI InChI=1S/C21H19Cl2IN2O5/c1-4-30-20(27)12-8-6-11(7-9-12)17-14(21(28)31-5-2)15(22)13-16(24)18(23)26(10-29-3)19(13)25-17/h6-9H,4-5,10H2,1-3H3
InChIKey YKOYTLBRLLBAIB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201303490
Molecular Weight 577.202 g/mol
SMILES c1(C(=O)OCC)c(c2c(c([n](c2nc1-c1ccc(cc1)C(=O)OCC)COC)Cl)I)Cl
SPLASH splash10-0002-9000380000-a6d943bc863b58773d44
Source of Spectrum ACI-52-SM21-27
Synonyms Ethyl 2,4-dichloro-6-(4-(ethoxycarbonyl)phenyl)-3-iodo-1-(methoxymethyl)-1H-pyrrolo[2,3-b]pyridine-5-carboxylate
Wiley ID 1781536