| SpectraBase Compound ID | KXZfyYNBOyg |
|---|---|
| InChI | InChI=1S/C23H37NO2/c1-3-21(2)15-12-10-8-6-4-5-7-9-11-13-17-23(25)26-20-22-16-14-18-24-19-22/h5,7,14,16,18-19,21H,3-4,6,8-13,15,17,20H2,1-2H3/b7-5- |
| InChIKey | OFTUWJXOSKLGAC-ALCCZGGFSA-N |
| Mol Weight | 359.6 g/mol |
| Molecular Formula | C23H37NO2 |
| Exact Mass | 359.282429 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9JKBgQdatDs |
|---|---|
| Name | Picolinyl 14-methyl-hexadec-6-enoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 359.282429433 u |
| Formula | C23H37NO2 |
| InChI | InChI=1S/C23H37NO2/c1-3-21(2)15-12-10-8-6-4-5-7-9-11-13-17-23(25)26-20-22-16-14-18-24-19-22/h5,7,14,16,18-19,21H,3-4,6,8-13,15,17,20H2,1-2H3/b7-5- |
| InChIKey | OFTUWJXOSKLGAC-ALCCZGGFSA-N |
| Molecular Weight | 359.554 g/mol |
| SMILES | C1=CN=CC(=C1)COC(CCCC\C=C/CCCCCCC(CC)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.89488 |