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2-AMINO-5-BENZYL-3-CYANO-4-METHYL-PYRROLE;PROTONATED

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2-AMINO-5-BENZYL-3-CYANO-4-METHYL-PYRROLE;PROTONATED
SpectraBase Compound ID 52psLd1LwXf
InChI InChI=1S/C13H13N3/c1-9-11(8-14)13(15)16-12(9)7-10-5-3-2-4-6-10/h2-6,16H,7,15H2,1H3/p+1
InChIKey BWAUXRJLNREQCA-UHFFFAOYSA-O
Mol Weight 212.28 g/mol
Molecular Formula C13H14N3
Exact Mass 212.118772 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9spraQ8iKIi
Name 2-AMINO-5-BENZYL-3-CYANO-4-METHYL-PYRROLE;PROTONATED
Compound Number 7B
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C13H13N3/c1-9-11(8-14)13(15)16-12(9)7-10-5-3-2-4-6-10/h2-6,16H,7,15H2,1H3/p+1
InChIKey BWAUXRJLNREQCA-UHFFFAOYSA-O
Literature Reference G.CIRRINCIONE,A.M.ALMERICO,P.DIANA,P.BARRAJA,F.MINGOIA,S.GRIMAUDO,G.DATTOLO,E.AI J.HETCYCL.CHEM.,33,161(1996)
Solvent Dimethyl sulfoxide-d6:Trifluoroacetic acid