| SpectraBase Spectrum ID |
7kb1M9Heew7 |
| Name |
Picolinyl 18-fluoro-octadec-9-enoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
391.288657629 u |
| Formula |
C24H38FNO2 |
| InChI |
InChI=1S/C24H38FNO2/c25-19-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-18-24(27)28-22-23-17-16-20-26-21-23/h1-2,16-17,20-21H,3-15,18-19,22H2/b2-1- |
| InChIKey |
AVCMDIMJSZKIOS-UPHRSURJSA-N |
| Molecular Weight |
391.571 g/mol |
| SMILES |
C(CC(=O)OCC1=CC=CN=C1)CCCCC\C=C/CCCCCCCCF |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.952148 |
