SpectraBase Spectrum ID |
8a8YvXUYMrI |
Name |
3-Methyl-1,4'-bipiperidine, N-pentafluoropropionyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
328.157404118 u |
Formula |
C14H21F5N2O |
InChI |
InChI=1S/C14H21F5N2O/c1-10-3-2-6-21(9-10)11-4-7-20(8-5-11)12(22)13(15,16)14(17,18)19/h10-11H,2-9H2,1H3 |
InChIKey |
MMFCNGWDCRJGSF-UHFFFAOYSA-N |
Molecular Weight |
328.327 g/mol |
SMILES |
C1N(CCCC1C)C1CCN(CC1)C(C(C(F)(F)F)(F)F)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.810944 |