SpectraBase Spectrum ID |
J5N72qIkRtC |
Name |
5-Acetyl-6-methyl-4-(2-methylphenyl)-3,4-dihydro-1H-pyridin-2-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
243.125928789 u |
Formula |
C15H17NO2 |
InChI |
InChI=1S/C15H17NO2/c1-9-6-4-5-7-12(9)13-8-14(18)16-10(2)15(13)11(3)17/h4-7,13H,8H2,1-3H3,(H,16,18) |
InChIKey |
RYBSKPJAIMRZPH-UHFFFAOYSA-N |
Molecular Weight |
243.306 g/mol |
SMILES |
C1(=C(NC(CC1C=1C(C)=CC=CC1)=O)C)C(=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.982506 |