| SpectraBase Compound ID | BAPTFO3vDXc |
|---|---|
| InChI | InChI=1S/C16H13N3O2/c17-15-13(8-12-5-1-2-6-14(12)21-15)16(20)19-10-11-4-3-7-18-9-11/h1-9,17H,10H2,(H,19,20) |
| InChIKey | BPBOJEILYGGODR-UHFFFAOYSA-N |
| Mol Weight | 279.3 g/mol |
| Molecular Formula | C16H13N3O2 |
| Exact Mass | 279.100777 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H5ATEz4WYNG |
|---|---|
| Name | 2-Imino-N-(3-pyridinylmethyl)-2H-chromene-3-carboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.100776669 u |
| Formula | C16H13N3O2 |
| InChI | InChI=1S/C16H13N3O2/c17-15-13(8-12-5-1-2-6-14(12)21-15)16(20)19-10-11-4-3-7-18-9-11/h1-9,17H,10H2,(H,19,20) |
| InChIKey | BPBOJEILYGGODR-UHFFFAOYSA-N |
| Molecular Weight | 279.299 g/mol |
| SMILES | N=C1C(C(NCC2=CN=CC=C2)=O)=CC2=C(O1)C=CC=C2 |