SpectraBase Spectrum ID |
7ISKsi4LfgV |
Name |
Benzamide, 2-fluoro-N-benzyl-N-hexadecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
453.340693203 u |
Formula |
C30H44FNO |
InChI |
InChI=1S/C30H44FNO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-20-25-32(26-27-21-16-15-17-22-27)30(33)28-23-18-19-24-29(28)31/h15-19,21-24H,2-14,20,25-26H2,1H3 |
InChIKey |
OTYAGPFQEYCULQ-UHFFFAOYSA-N |
Molecular Weight |
453.686 g/mol |
SMILES |
C(N(CCCCCCCCCCCCCCCC)CC1=CC=CC=C1)(=O)C=1C(F)=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.830917 |