SpectraBase Spectrum ID |
1DVkENaHIOn |
Name |
Acetamide, 2-phenyl-N-butyl-N-isobutyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
247.193614428 u |
Formula |
C16H25NO |
InChI |
InChI=1S/C16H25NO/c1-4-5-11-17(13-14(2)3)16(18)12-15-9-7-6-8-10-15/h6-10,14H,4-5,11-13H2,1-3H3 |
InChIKey |
MDCSFNVSHFYXME-UHFFFAOYSA-N |
Molecular Weight |
247.382 g/mol |
SMILES |
C(C(=O)N(CC(C)C)CCCC)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.946342 |