| SpectraBase Compound ID | GmPETalv4J2 |
|---|---|
| InChI | InChI=1S/C10H11NO/c1-12-10-7-3-2-5-9(10)6-4-8-11/h2-3,5,7H,4,6H2,1H3 |
| InChIKey | NSDFFKLRIYOAFO-UHFFFAOYSA-N |
| Mol Weight | 161.2 g/mol |
| Molecular Formula | C10H11NO |
| Exact Mass | 161.084064 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 | EVtWlbK678a |
|---|---|
| Name | 3-(2-Methoxyphenyl)propanenitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 161.084063977 u |
| Formula | C10H11NO |
| InChI | InChI=1S/C10H11NO/c1-12-10-7-3-2-5-9(10)6-4-8-11/h2-3,5,7H,4,6H2,1H3 |
| InChIKey | NSDFFKLRIYOAFO-UHFFFAOYSA-N |
| Molecular Weight | 161.204 g/mol |
| SMILES | C=1C=C(CCC#N)C(=CC1)OC |