| SpectraBase Compound ID | I5RGDrYFuCQ |
|---|---|
| InChI | InChI=1S/C14H11NO/c15-11-10-12-6-4-5-9-14(12)16-13-7-2-1-3-8-13/h1-9H,10H2 |
| InChIKey | PCMQCXFXODBYGN-UHFFFAOYSA-N |
| Mol Weight | 209.25 g/mol |
| Molecular Formula | C14H11NO |
| Exact Mass | 209.084064 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AoN2LkawbOi |
|---|---|
| Name | 2-Phenoxyphenylacetonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 209.084063977 u |
| Formula | C14H11NO |
| InChI | InChI=1S/C14H11NO/c15-11-10-12-6-4-5-9-14(12)16-13-7-2-1-3-8-13/h1-9H,10H2 |
| InChIKey | PCMQCXFXODBYGN-UHFFFAOYSA-N |
| Molecular Weight | 209.248 g/mol |
| SMILES | C1=C(C(=CC=C1)OC=1C=CC=CC1)CC#N |