| SpectraBase Spectrum ID |
HprIdmQTG45 |
| Name |
1-Piperidin-4-ylazepane, N-trifluoroacetyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
278.160597792 u |
| Formula |
C13H21F3N2O |
| InChI |
InChI=1S/C13H21F3N2O/c14-13(15,16)12(19)18-9-5-11(6-10-18)17-7-3-1-2-4-8-17/h11H,1-10H2 |
| InChIKey |
LUUYLVXYKYYMSH-UHFFFAOYSA-N |
| Molecular Weight |
278.319 g/mol |
| SMILES |
C1N(CCC(C1)N1CCCCCC1)C(C(F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.961816 |
