John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=10DFqayuIgP SpectraBase Spectrum ID=EkuQxzimo0G

(accessed ).
1-ACETO-2-AMINO-3-CYANO-4,5-DIMETHYL-4H-PYRROLE;N-PROTONATED
SpectraBase Compound ID 10DFqayuIgP
InChI InChI=1S/C9H11N3O/c1-5-6(2)12(7(3)13)9(11)8(5)4-10/h6,11H,1-3H3/p+1
InChIKey PMYOTTFQOACSNT-UHFFFAOYSA-O
Mol Weight 178.21 g/mol
Molecular Formula C9H12N3O
Exact Mass 178.098037 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EkuQxzimo0G
Name 1-ACETO-2-AMINO-3-CYANO-4,5-DIMETHYL-4H-PYRROLE;N-PROTONATED
Compound Number 4A
Copyright Copyright © 1980, 1981-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C9H11N3O/c1-5-6(2)12(7(3)13)9(11)8(5)4-10/h6,11H,1-3H3/p+1
InChIKey PMYOTTFQOACSNT-UHFFFAOYSA-O
Literature Reference A.M.ALMERICO,G.CIRRINCIONE,P.DIANA,S.GRIMAUDO,G.DATTOLO,E.AIELLO,F.MINGOIA J.HETCYCL.CHEM.,32,985(1995)
Solvent Trifluoroacetic acid
SpectraBase Batch ID KLT1TZGCB9m