SpectraBase Spectrum ID |
H30GWLLcSWS |
Name |
1-Isobutylpiperidine-4-carboxylic acid, (tetrahydrofuran-2-ylmethyl)amide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
268.215078148 u |
Formula |
C15H28N2O2 |
InChI |
InChI=1S/C15H28N2O2/c1-12(2)11-17-7-5-13(6-8-17)15(18)16-10-14-4-3-9-19-14/h12-14H,3-11H2,1-2H3,(H,16,18) |
InChIKey |
BMKRXSMMNJGRCG-UHFFFAOYSA-N |
Molecular Weight |
268.401 g/mol |
SMILES |
C1(CCN(CC1)CC(C)C)C(NCC1CCCO1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.958719 |