SpectraBase Spectrum ID |
CSs5MAuP1tJ |
Name |
N-(Butoxycarbonyl)-2-[(E)-prop-1-enyl]piperidine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
225.172878983 u |
Formula |
C13H23NO2 |
InChI |
InChI=1S/C13H23NO2/c1-5-8-11-9-6-7-10-14(11)12(15)16-13(2,3)4/h5,8,11H,6-7,9-10H2,1-4H3/b8-5+ |
InChIKey |
CNNWHKJTPYEWPX-VMPITWQZSA-N |
Molecular Weight |
225.332 g/mol |
SMILES |
C(N1C(\C=C\C)CCCC1)(OC(C)(C)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.912517 |