| SpectraBase Spectrum ID |
B4QQDzngSht |
| Name |
2-{2-(10-Methoxydecyl)phenyl}pyridine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
325.240564621 u |
| Formula |
C22H31NO |
| InChI |
InChI=1S/C22H31NO/c1-24-19-13-7-5-3-2-4-6-8-14-20-15-9-10-16-21(20)22-17-11-12-18-23-22/h9-12,15-18H,2-8,13-14,19H2,1H3 |
| InChIKey |
KOHZUYMRTGGEDK-UHFFFAOYSA-N |
| Molecular Weight |
325.496 g/mol |
| SMILES |
C=1C(C=2C=CC=CN2)=C(CCCCCCCCCCOC)C=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.833969 |
