| SpectraBase Compound ID | B7BveAjlLNV |
|---|---|
| InChI | InChI=1S/C16H14N2O/c19-16(18-10-12-6-2-1-3-7-12)14-11-17-15-9-5-4-8-13(14)15/h1-9,11,17H,10H2,(H,18,19) |
| InChIKey | TXDLQVDBWSBJJX-UHFFFAOYSA-N |
| Mol Weight | 250.3 g/mol |
| Molecular Formula | C16H14N2O |
| Exact Mass | 250.110613 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DulMEIT1hSZ |
|---|---|
| Name | 5F-sdb-006-A (-C5H9F) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.110613078 u |
| Formula | C16H14N2O |
| InChI | InChI=1S/C16H14N2O/c19-16(18-10-12-6-2-1-3-7-12)14-11-17-15-9-5-4-8-13(14)15/h1-9,11,17H,10H2,(H,18,19) |
| InChIKey | TXDLQVDBWSBJJX-UHFFFAOYSA-N |
| Molecular Weight | 250.301 g/mol |
| SMILES | C=1(C=2C(NC1)=CC=CC2)C(NCC1=CC=CC=C1)=O |