SpectraBase Spectrum ID |
BoUYoQx7pZt |
Name |
1-Methyl-2-cyano-3-ethyl-4-pivaloyl-2-piperideine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
234.173213335 u |
Formula |
C14H22N2O |
InChI |
InChI=1S/C14H22N2O/c1-6-10-11(13(17)14(2,3)4)7-8-16(5)12(10)9-15/h11H,6-8H2,1-5H3 |
InChIKey |
FLIBXMSYSJJUQP-UHFFFAOYSA-N |
Molecular Weight |
234.343 g/mol |
SMILES |
C=1(N(CCC(C1CC)C(C(C)(C)C)=O)C)C#N |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.86919 |