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3-CYANO-2-HYDROXY-1-METHYL-5-PHENYLPYRROLE-4-CARBOXALDEHYDE
SpectraBase Compound ID ADnywIVw6qm
InChI InChI=1S/C13H10N2O2/c1-15-12(9-5-3-2-4-6-9)11(8-16)10(7-14)13(15)17/h2-6,8,17H,1H3
InChIKey DJFAJERTRKDMMA-UHFFFAOYSA-N
Mol Weight 226.23 g/mol
Molecular Formula C13H10N2O2
Exact Mass 226.074228 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8ZfuCflkohk
Name 3-CYANO-2-HYDROXY-1-METHYL-5-PHENYLPYRROLE-4-CARBOXALDEHYDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H10N2O2
InChI InChI=1S/C13H10N2O2/c1-15-12(9-5-3-2-4-6-9)11(8-16)10(7-14)13(15)17/h2-6,8,17H,1H3
InChIKey DJFAJERTRKDMMA-UHFFFAOYSA-N
Literature Reference Author J.BECHER,P.L.JORGENSEN,K.PLUTA,N.J.KRAKE,B.FAELT-HANSEN
Literature Reference Citation J.ORG.CHEM.,57,2127(1992)
Literature Reference DOI 10.1021/jo00033a039
Molecular Weight 226.235 g/mol
Solvent DMSO-D6
Source File Reference UWCS1996