SpectraBase Spectrum ID |
GRX73lkwTSX |
Name |
Benzamide, 2,5-difluoro-N-benzyl-N-pentyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
317.159120625 u |
Formula |
C19H21F2NO |
InChI |
InChI=1S/C19H21F2NO/c1-2-3-7-12-22(14-15-8-5-4-6-9-15)19(23)17-13-16(20)10-11-18(17)21/h4-6,8-11,13H,2-3,7,12,14H2,1H3 |
InChIKey |
DPEJKBHZXKCOIM-UHFFFAOYSA-N |
Molecular Weight |
317.380 g/mol |
SMILES |
C(N(CCCCC)CC1=CC=CC=C1)(=O)C=1C(F)=CC=C(F)C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.817165 |