SpectraBase Spectrum ID |
8CrDGwEQl6d |
Name |
Butyramide, 2-ethyl-N-benzyl-N-hexadecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
429.397065265 u |
Formula |
C29H51NO |
InChI |
InChI=1S/C29H51NO/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-22-25-30(29(31)28(5-2)6-3)26-27-23-20-19-21-24-27/h19-21,23-24,28H,4-18,22,25-26H2,1-3H3 |
InChIKey |
QJVNVBVNSHBTRO-UHFFFAOYSA-N |
Molecular Weight |
429.733 g/mol |
SMILES |
C(N(CCCCCCCCCCCCCCCC)CC1=CC=CC=C1)(=O)C(CC)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.883188 |