| SpectraBase Compound ID | 978fAkqDj5N |
|---|---|
| InChI | InChI=1S/C11H17NO2/c1-3-5-6-7-8-10(9-12)11(13)14-4-2/h8H,3-7H2,1-2H3/b10-8+ |
| InChIKey | MYNPFRJYBWWTGO-CSKARUKUSA-N |
| Mol Weight | 195.26 g/mol |
| Molecular Formula | C11H17NO2 |
| Exact Mass | 195.125929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4ZPzJNyKvYi |
|---|---|
| Name | (E)-2-Cyano-2-octenoic acid ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 195.125928789 u |
| Formula | C11H17NO2 |
| InChI | InChI=1S/C11H17NO2/c1-3-5-6-7-8-10(9-12)11(13)14-4-2/h8H,3-7H2,1-2H3/b10-8+ |
| InChIKey | MYNPFRJYBWWTGO-CSKARUKUSA-N |
| Molecular Weight | 195.262 g/mol |
| SMILES | C(\C(=C\CCCCC)C#N)(=O)OCC |