SpectraBase Spectrum ID |
KMvWYhCnRKK |
Name |
Pyrrolidine-3-carboxamide, N-isopropyl-1-(2-methylphenyl)-5-oxo- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
260.152477890 u |
Formula |
C15H20N2O2 |
InChI |
InChI=1S/C15H20N2O2/c1-10(2)16-15(19)12-8-14(18)17(9-12)13-7-5-4-6-11(13)3/h4-7,10,12H,8-9H2,1-3H3,(H,16,19) |
InChIKey |
JHLPZVPQBIYUFG-UHFFFAOYSA-N |
Molecular Weight |
260.337 g/mol |
SMILES |
C1=CC=C(N2C(CC(C2)C(NC(C)C)=O)=O)C(=C1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.895502 |