| SpectraBase Compound ID | EPhmRH2ZWut |
|---|---|
| InChI | InChI=1S/C17H16N2O2/c1-12-11-18-16(17(20)21-2)15(12)14-9-6-10-19(14)13-7-4-3-5-8-13/h3-11,18H,1-2H3 |
| InChIKey | NQCAGVMRNQLROS-UHFFFAOYSA-N |
| Mol Weight | 280.33 g/mol |
| Molecular Formula | C17H16N2O2 |
| Exact Mass | 280.121178 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9gkHrf0gfAo |
|---|---|
| Name | Methyl 4-methyl-3-[N-(phenyl)pyrrol-2-yl)-1H-pyrrole-2-carboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.121177761 u |
| Formula | C17H16N2O2 |
| InChI | InChI=1S/C17H16N2O2/c1-12-11-18-16(17(20)21-2)15(12)14-9-6-10-19(14)13-7-4-3-5-8-13/h3-11,18H,1-2H3 |
| InChIKey | NQCAGVMRNQLROS-UHFFFAOYSA-N |
| SMILES | C1(C=2N(C=CC2)C=2C=CC=CC2)=C(NC=C1C)C(=O)OC |