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3-(2-HYDROXYETHYL)-5-IODO-4-METHYLPYRROLE-2-CARBOXALDEHYDE,ACETATE (ESTER)
SpectraBase Compound ID IJU4UwXbDzL
InChI InChI=1S/C10H12INO3/c1-6-8(3-4-15-7(2)14)9(5-13)12-10(6)11/h5,12H,3-4H2,1-2H3
InChIKey KEIQXTWUUXPPMP-UHFFFAOYSA-N
Mol Weight 321.11 g/mol
Molecular Formula C10H12INO3
Exact Mass 320.986188 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K67ubPtAnHZ
Name 5-Formyl-1-iodo-3-methyl-4-(2-acetoxy-ethyl)-pyrrole
CAS Registry Number 52090-93-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H12INO3
InChI InChI=1S/C10H12INO3/c1-6-8(3-4-15-7(2)14)9(5-13)12-10(6)11/h5,12H,3-4H2,1-2H3
InChIKey KEIQXTWUUXPPMP-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference A.R. Battersby, G.L. Hodgson, M.Ihara, J. Chem. Soc. Perkin I 2923 (1973).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3