SpectraBase Spectrum ID |
ILBIGIcFAK5 |
Name |
Acetamide, 2-phenyl-N-butyl-N-ethyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
219.162314299 u |
Formula |
C14H21NO |
InChI |
InChI=1S/C14H21NO/c1-3-5-11-15(4-2)14(16)12-13-9-7-6-8-10-13/h6-10H,3-5,11-12H2,1-2H3 |
InChIKey |
UVWHMIMTPOWHCH-UHFFFAOYSA-N |
Molecular Weight |
219.328 g/mol |
SMILES |
C(C(=O)N(CC)CCCC)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.872609 |