SpectraBase Spectrum ID |
HtucJqQiXmu |
Name |
.alpha.-Pyrrolidone, N-benzyl-5-[3-hydroxypropyl]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
233.141578854 u |
Formula |
C14H19NO2 |
InChI |
InChI=1S/C14H19NO2/c16-10-4-7-13-8-9-14(17)15(13)11-12-5-2-1-3-6-12/h1-3,5-6,13,16H,4,7-11H2 |
InChIKey |
YQACWASPJFYDTP-UHFFFAOYSA-N |
Molecular Weight |
233.311 g/mol |
SMILES |
C1(N(C(CC1)CCCO)CC1=CC=CC=C1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.959087 |