| SpectraBase Compound ID | CjFIj0nGl0K |
|---|---|
| InChI | InChI=1S/C16H15NO2/c1-18-16-11-13(9-10-17)7-8-15(16)19-12-14-5-3-2-4-6-14/h2-8,11H,9,12H2,1H3 |
| InChIKey | KSOYPRFHKIOHMY-UHFFFAOYSA-N |
| Mol Weight | 253.3 g/mol |
| Molecular Formula | C16H15NO2 |
| Exact Mass | 253.110279 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Cquq7fiHdmj |
|---|---|
| Name | 4-Benzyloxy-3-methoxyphenylacetonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 253.110278725 u |
| Formula | C16H15NO2 |
| InChI | InChI=1S/C16H15NO2/c1-18-16-11-13(9-10-17)7-8-15(16)19-12-14-5-3-2-4-6-14/h2-8,11H,9,12H2,1H3 |
| InChIKey | KSOYPRFHKIOHMY-UHFFFAOYSA-N |
| Molecular Weight | 253.301 g/mol |
| SMILES | C1(OCC2=CC=CC=C2)=CC=C(C=C1OC)CC#N |