| SpectraBase Compound ID | 19ya6MSyRUP |
|---|---|
| InChI | InChI=1S/C14H13N3O/c18-14(13-9-15-6-7-16-13)17-12-5-4-10-2-1-3-11(10)8-12/h4-9H,1-3H2,(H,17,18) |
| InChIKey | XGGQXNMQEPPXQY-UHFFFAOYSA-N |
| Mol Weight | 239.28 g/mol |
| Molecular Formula | C14H13N3O |
| Exact Mass | 239.105862 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4wdZZtw7l98 |
|---|---|
| Name | N-(2,3-Dihydro-1H-inden-5-yl)-2-pyrazinecarboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 239.105862050 u |
| Formula | C14H13N3O |
| InChI | InChI=1S/C14H13N3O/c18-14(13-9-15-6-7-16-13)17-12-5-4-10-2-1-3-11(10)8-12/h4-9H,1-3H2,(H,17,18) |
| InChIKey | XGGQXNMQEPPXQY-UHFFFAOYSA-N |
| Molecular Weight | 239.278 g/mol |
| SMILES | N(C=1C=C2C(=CC1)CCC2)C(C1=NC=CN=C1)=O |