| SpectraBase Spectrum ID |
1WXxGxpFWWd |
| Name |
Butyramide, 4-(4-methoxyphenyl)-N-(2-pentyl)-N-undecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
417.360679755 u |
| Formula |
C27H47NO2 |
| InChI |
InChI=1S/C27H47NO2/c1-5-7-8-9-10-11-12-13-14-23-28(24(3)16-6-2)27(29)18-15-17-25-19-21-26(30-4)22-20-25/h19-22,24H,5-18,23H2,1-4H3 |
| InChIKey |
OJEWLIUVCPJTMG-UHFFFAOYSA-N |
| Molecular Weight |
417.678 g/mol |
| SMILES |
CCCC(N(C(=O)CCCC=1C=CC(OC)=CC1)CCCCCCCCCCC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.826727 |
