SpectraBase Spectrum ID |
JNGnMsUaj7O |
Name |
4-Benzoylpiperidine, N-acetyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
231.125928789 u |
Formula |
C14H17NO2 |
InChI |
InChI=1S/C14H17NO2/c1-11(16)15-9-7-13(8-10-15)14(17)12-5-3-2-4-6-12/h2-6,13H,7-10H2,1H3 |
InChIKey |
RQVMJPJBWMFWFT-UHFFFAOYSA-N |
Molecular Weight |
231.295 g/mol |
SMILES |
C1N(CCC(C1)C(=O)C1=CC=CC=C1)C(C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.970821 |