SpectraBase Spectrum ID |
GvXM3NcnEAf |
Name |
1-(2-Phenylethyl)-4-piperidinamine, N-acetyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
246.173213335 u |
Formula |
C15H22N2O |
InChI |
InChI=1S/C15H22N2O/c1-13(18)16-15-8-11-17(12-9-15)10-7-14-5-3-2-4-6-14/h2-6,15H,7-12H2,1H3,(H,16,18) |
InChIKey |
HKPWXRBITBLQDY-UHFFFAOYSA-N |
Molecular Weight |
246.354 g/mol |
SMILES |
C1N(CCC(C1)NC(C)=O)CCC1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956491 |