| SpectraBase Spectrum ID |
4FOH5XqBmT4 |
| Name |
Benzamide, 2-fluoro-N-(2-phenylethyl)-N-heptyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
341.215492688 u |
| Formula |
C22H28FNO |
| InChI |
InChI=1S/C22H28FNO/c1-2-3-4-5-11-17-24(18-16-19-12-7-6-8-13-19)22(25)20-14-9-10-15-21(20)23/h6-10,12-15H,2-5,11,16-18H2,1H3 |
| InChIKey |
KMAYKWBRKPBXDJ-UHFFFAOYSA-N |
| Molecular Weight |
341.470 g/mol |
| SMILES |
C1=CC=C(C(=C1)F)C(N(CCCCCCC)CCC1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.895518 |
