SpectraBase Spectrum ID |
9RVKeeL7EPI |
Name |
Benzamide, 2-fluoro-N-(2-phenylethyl)-N-dodecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
411.293743010 u |
Formula |
C27H38FNO |
InChI |
InChI=1S/C27H38FNO/c1-2-3-4-5-6-7-8-9-10-16-22-29(23-21-24-17-12-11-13-18-24)27(30)25-19-14-15-20-26(25)28/h11-15,17-20H,2-10,16,21-23H2,1H3 |
InChIKey |
DORKCMFQXKWANI-UHFFFAOYSA-N |
Molecular Weight |
411.605 g/mol |
SMILES |
C1=CC=C(C(=C1)F)C(N(CCCCCCCCCCCC)CCC1=CC=CC=C1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.840529 |