| SpectraBase Compound ID | AOV0UOKwmQi |
|---|---|
| InChI | InChI=1S/C13H11N3O/c1-9(17)16-8-12(11(7-14)13(16)15)10-5-3-2-4-6-10/h2-6,15H,8H2,1H3/p+1 |
| InChIKey | HTVDQSWAMOBRKF-UHFFFAOYSA-O |
| Mol Weight | 226.26 g/mol |
| Molecular Formula | C13H12N3O |
| Exact Mass | 226.098037 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 76ltKNfzX8y |
|---|---|
| Name | 1-ACETO-2-AMINO-3-CYANO-4-PHENYL-4H-PYRROLE;N-PROTONATED |
| Compound Number | 4C |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C13H11N3O/c1-9(17)16-8-12(11(7-14)13(16)15)10-5-3-2-4-6-10/h2-6,15H,8H2,1H3/p+1 |
| InChIKey | HTVDQSWAMOBRKF-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 |