SpectraBase Spectrum ID |
AsVdjzCKj88 |
Name |
Pent-4-enoylamide, 2-methyl-N-benzyl-N-decyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
343.287514814 u |
Formula |
C23H37NO |
InChI |
InChI=1S/C23H37NO/c1-4-6-7-8-9-10-11-15-19-24(23(25)21(3)16-5-2)20-22-17-13-12-14-18-22/h5,12-14,17-18,21H,2,4,6-11,15-16,19-20H2,1,3H3 |
InChIKey |
MERRDNJOHPHNHX-UHFFFAOYSA-N |
Molecular Weight |
343.555 g/mol |
SMILES |
C(N(CCCCCCCCCC)CC1=CC=CC=C1)(=O)C(CC=C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.908143 |