SpectraBase Spectrum ID |
IbRbvmUSo0r |
Name |
Decanoylamide, N-benzyl-N-undecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
415.381415201 u |
Formula |
C28H49NO |
InChI |
InChI=1S/C28H49NO/c1-3-5-7-9-11-12-14-16-21-25-29(26-27-22-18-17-19-23-27)28(30)24-20-15-13-10-8-6-4-2/h17-19,22-23H,3-16,20-21,24-26H2,1-2H3 |
InChIKey |
YTGOACPJUFRYBE-UHFFFAOYSA-N |
Molecular Weight |
415.706 g/mol |
SMILES |
C(N(CCCCCCCCCCC)CC1=CC=CC=C1)(=O)CCCCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933515 |