SpectraBase Spectrum ID |
AtWFPjyqC77 |
Name |
Pyrrolidine-2,5-dione, 3-(4-benzyl-1-piperidyl)-1-ethyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
300.183778019 u |
Formula |
C18H24N2O2 |
InChI |
InChI=1S/C18H24N2O2/c1-2-20-17(21)13-16(18(20)22)19-10-8-15(9-11-19)12-14-6-4-3-5-7-14/h3-7,15-16H,2,8-13H2,1H3 |
InChIKey |
QMPXTDFIZSMXBR-UHFFFAOYSA-N |
Molecular Weight |
300.402 g/mol |
SMILES |
C1=CC=C(C=C1)CC1CCN(C2C(N(C(=O)C2)CC)=O)CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.842711 |