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Ethyl 3-Iodo-5-methoxy-1H-indole-2-carboxylate
SpectraBase Compound ID 1GAyw4T1UPk
InChI InChI=1S/C12H12INO3/c1-3-17-12(15)11-10(13)8-6-7(16-2)4-5-9(8)14-11/h4-6,14H,3H2,1-2H3
InChIKey IARJKNHXAFLGMJ-UHFFFAOYSA-N
Mol Weight 345.14 g/mol
Molecular Formula C12H12INO3
Exact Mass 344.986188 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hc0SgsK7F78
Name Ethyl 3-Iodo-5-methoxy-1H-indole-2-carboxylate
Appearance Brown solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 344.986188247 u
Formula C12H12INO3
InChI InChI=1S/C12H12INO3/c1-3-17-12(15)11-10(13)8-6-7(16-2)4-5-9(8)14-11/h4-6,14H,3H2,1-2H3
InChIKey IARJKNHXAFLGMJ-UHFFFAOYSA-N
Instrument Name Hewlett Packard 5988A
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201801167
Molecular Weight 345.136 g/mol
Quality 270
Reported Formula C12H12INO3
SMILES N1C2=C(C(=C1C(OCC)=O)I)C=C(C=C2)OC
SPLASH splash10-0002-2795000000-f0a609d99dd36b68a5f9
Source of Spectrum K1-2018-6320-5c (DOI: 10.1002/ejoc.201801167)
Thin-Layer Chromatography 0.79 (EtOAc/PE, 20:80)
Wiley ID 1894399