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3-[1-(2-IODOPHENYL)-1-HYDROXYMETHYL]-2-METHYL-2,3-DIHYDRO-1H-PYRROLO-[3,4-C]-PYRIDIN-1-ONE
SpectraBase Compound ID 56BHC0ge9sJ
InChI InChI=1S/C15H13IN2O2/c1-18-13(11-8-17-7-6-9(11)15(18)20)14(19)10-4-2-3-5-12(10)16/h2-8,13-14,19H,1H3/t13-,14+/m1/s1
InChIKey CYTKAFXPZUEMIE-KGLIPLIRSA-N
Mol Weight 380.19 g/mol
Molecular Formula C15H13IN2O2
Exact Mass 380.002173 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2lI8YDwSVkD
Name 3-[1-(2-IODOPHENYL)-1-HYDROXYMETHYL]-2-METHYL-2,3-DIHYDRO-1H-PYRROLO-[3,4-C]-PYRIDIN-1-ONE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H13IN2O2
InChI InChI=1S/C15H13IN2O2/c1-18-13(11-8-17-7-6-9(11)15(18)20)14(19)10-4-2-3-5-12(10)16/h2-8,13-14,19H,1H3/t13-,14+/m1/s1
InChIKey CYTKAFXPZUEMIE-KGLIPLIRSA-N
Literature Reference Author C.HOARAU,A.COUTURE,H.CORNET,E.DENIAU,P.GRANDCLAUDON
Literature Reference Citation J.ORG.CHEM.,66,8064(2001)
Literature Reference DOI 10.1021/jo0105944
Molecular Weight 380.185 g/mol
Solvent DMSO-D6
Source File Reference UWVN26046