| SpectraBase Spectrum ID |
CH8r3N5CREx |
| Name |
N-(4-Methylphenyl)-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 |
490.185510573 u |
| Formula |
C24H25F7N2O |
| InChI |
InChI=1S/C24H25F7N2O/c1-17-7-9-19(10-8-17)33(21(34)22(25,26)23(27,28)24(29,30)31)20-12-15-32(16-13-20)14-11-18-5-3-2-4-6-18/h2-10,20H,11-16H2,1H3 |
| InChIKey |
SJEAGPRUNBLQSV-UHFFFAOYSA-N |
| Molecular Weight |
490.466 g/mol |
| SMILES |
C(C(C(F)(F)F)(F)F)(C(N(C1CCN(CC1)CCC1=CC=CC=C1)C1=CC=C(C=C1)C)=O)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.882177 |
![N-(4-Methylphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]heptafluorobutanamide](/api/spectrum/CH8r3N5CREx/structure.png?h=300&w=458 "N-(4-Methylphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]heptafluorobutanamide")
