| SpectraBase Compound ID | 52ps2Gr3Cj9 |
|---|---|
| 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 |
| InChIKey | BWAUXRJLNREQCA-UHFFFAOYSA-N |
| Mol Weight | 211.27 g/mol |
| Molecular Formula | C13H13N3 |
| Exact Mass | 211.110947 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BSup6xEYT4S |
|---|---|
| Name | 2-AMINO-5-BENZYL-3-CYANO-4-METHYL-PYRROLE |
| Compound Number | 7B |
| Copyright | Copyright © 1980, 1981-2025 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 |
| InChIKey | BWAUXRJLNREQCA-UHFFFAOYSA-N |
| 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 |