| SpectraBase Spectrum ID |
92ZnBKx0UWJ |
| Name |
Picolinyl 17-hexacosenoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
485.423280013 u |
| Formula |
C32H55NO2 |
| InChI |
InChI=1S/C32H55NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27-32(34)35-30-31-26-25-28-33-29-31/h9-10,25-26,28-29H,2-8,11-24,27,30H2,1H3/b10-9- |
| InChIKey |
JGFTWGUJJOEESY-KTKRTIGZSA-N |
| Molecular Weight |
485.797 g/mol |
| SMILES |
C(CC(=O)OCC1=CC=CN=C1)CCCCCCCCCCCCC\C=C/CCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.923038 |
