SpectraBase Spectrum ID |
BKJSo1yNWmF |
Name |
1-Phenyl-3-(1-piperidinyl)-2-pyrrolidinone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
244.157563271 u |
Formula |
C15H20N2O |
InChI |
InChI=1S/C15H20N2O/c18-15-14(16-10-5-2-6-11-16)9-12-17(15)13-7-3-1-4-8-13/h1,3-4,7-8,14H,2,5-6,9-12H2 |
InChIKey |
TYGVJQQISVEFSH-UHFFFAOYSA-N |
Molecular Weight |
244.338 g/mol |
SMILES |
C1N(C(C(C1)N1CCCCC1)=O)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.915495 |