| SpectraBase Spectrum ID |
JrgXHzQe1P3 |
| Name |
Benzamide, 2-fluoro-N-benzyl-N-(hept-2-yl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
327.199842623 u |
| Formula |
C21H26FNO |
| InChI |
InChI=1S/C21H26FNO/c1-3-4-6-11-17(2)23(16-18-12-7-5-8-13-18)21(24)19-14-9-10-15-20(19)22/h5,7-10,12-15,17H,3-4,6,11,16H2,1-2H3 |
| InChIKey |
DYJNBGKELWOQFB-UHFFFAOYSA-N |
| Molecular Weight |
327.443 g/mol |
| SMILES |
C(N(C(CCCCC)C)CC1=CC=CC=C1)(=O)C=1C(F)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.838223 |
