SpectraBase Spectrum ID |
3IJLuBDgc9v |
Name |
Benzamide, 2,5-difluoro-N-(2-pentyl)-N-decyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
367.268671076 u |
Formula |
C22H35F2NO |
InChI |
InChI=1S/C22H35F2NO/c1-4-6-7-8-9-10-11-12-16-25(18(3)13-5-2)22(26)20-17-19(23)14-15-21(20)24/h14-15,17-18H,4-13,16H2,1-3H3 |
InChIKey |
BFSYOHDGZNVDTR-UHFFFAOYSA-N |
Molecular Weight |
367.525 g/mol |
SMILES |
C(C1=C(C=CC(=C1)F)F)(N(CCCCCCCCCC)C(CCC)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.805322 |