SpectraBase Spectrum ID |
1hsfxN8aGPO |
Name |
Benzamide, 2,6-difluoro-3-methyl-N-(2-pentyl)-N-butyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
297.190420754 u |
Formula |
C17H25F2NO |
InChI |
InChI=1S/C17H25F2NO/c1-5-7-11-20(13(4)8-6-2)17(21)15-14(18)10-9-12(3)16(15)19/h9-10,13H,5-8,11H2,1-4H3 |
InChIKey |
CIRHPNNAMLUQPN-UHFFFAOYSA-N |
Molecular Weight |
297.390 g/mol |
SMILES |
C(C1=C(C(=CC=C1F)C)F)(N(CCCC)C(CCC)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.909125 |