| SpectraBase Compound ID | 5jEeU4HugKh |
|---|---|
| InChI | InChI=1S/C16H12N2O2/c17-9-10-18-16(19)15-11-5-1-3-7-13(11)20-14-8-4-2-6-12(14)15/h1-8,15H,10H2,(H,18,19) |
| InChIKey | FBLFTTGITNFUOX-UHFFFAOYSA-N |
| Mol Weight | 264.28 g/mol |
| Molecular Formula | C16H12N2O2 |
| Exact Mass | 264.089878 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | JT3SnqTk3OW |
|---|---|
| Name | N-(Cyanomethyl)-9H-xanthene-9-carboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.089877632 u |
| Formula | C16H12N2O2 |
| InChI | InChI=1S/C16H12N2O2/c17-9-10-18-16(19)15-11-5-1-3-7-13(11)20-14-8-4-2-6-12(14)15/h1-8,15H,10H2,(H,18,19) |
| InChIKey | FBLFTTGITNFUOX-UHFFFAOYSA-N |
| Molecular Weight | 264.284 g/mol |
| SMILES | N(C(C1C=2C(=CC=CC2)OC2=C1C=CC=C2)=O)CC#N |