| SpectraBase Spectrum ID |
FwAcZrBJvIp |
| Name |
N-(2-Fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]heptafluorobutanamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
494.160438639 u |
| Formula |
C23H22F8N2O |
| InChI |
InChI=1S/C23H22F8N2O/c24-18-8-4-5-9-19(18)33(20(34)21(25,26)22(27,28)23(29,30)31)17-11-14-32(15-12-17)13-10-16-6-2-1-3-7-16/h1-9,17H,10-15H2 |
| InChIKey |
GNINSKQUOVGXOO-UHFFFAOYSA-N |
| Molecular Weight |
494.429 g/mol |
| SMILES |
C(C(C(F)(F)F)(F)F)(C(N(C=1C(=CC=CC1)F)C1CCN(CC1)CCC1=CC=CC=C1)=O)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.867624 |