SpectraBase Spectrum ID |
28y7kBX8J1k |
Name |
2-(Prop-2-en-1-yl)-2-(pyrrolidin-1-ylcarbonyl)-3-cyclohexen-1-one |
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/c1-2-8-14(9-4-3-7-12(14)16)13(17)15-10-5-6-11-15/h2,4,9H,1,3,5-8,10-11H2 |
InChIKey |
RZDNOFZYBXIYIT-UHFFFAOYSA-N |
Molecular Weight |
233.311 g/mol |
SMILES |
C1(C(C=CCC1)(C(=O)N1CCCC1)CC=C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.878481 |