SpectraBase Spectrum ID |
Hzg9Qe6SIY8 |
Name |
3-Methyl-1,4'-bipiperidine, 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/c1-10-3-2-6-18(9-10)11-4-7-17(8-5-11)12(19)13(14,15)16/h10-11H,2-9H2,1H3 |
InChIKey |
BJLPGEKYTOAWRV-UHFFFAOYSA-N |
Molecular Weight |
278.319 g/mol |
SMILES |
C1N(CCCC1C)C1CCN(CC1)C(C(F)(F)F)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.967003 |