SpectraBase Spectrum ID |
9alEPv0Maid |
Name |
Benzamide, 4-butyl-N-allyl-N-dodecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
385.334465008 u |
Formula |
C26H43NO |
InChI |
InChI=1S/C26H43NO/c1-4-7-9-10-11-12-13-14-15-16-23-27(22-6-3)26(28)25-20-18-24(19-21-25)17-8-5-2/h6,18-21H,3-5,7-17,22-23H2,1-2H3 |
InChIKey |
CHHJYICYDZZOEN-UHFFFAOYSA-N |
Molecular Weight |
385.636 g/mol |
SMILES |
C(N(CCCCCCCCCCCC)CC=C)(=O)C=1C=CC(=CC1)CCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918977 |