SpectraBase Compound ID | 2s0ve8ysZgX |
---|---|
InChI | InChI=1S/C13H13NO/c1-9-10(2)14-13(15)8-12(9)11-6-4-3-5-7-11/h3-8H,1-2H3,(H,14,15) |
InChIKey | WHKVRBAPEBRGTI-UHFFFAOYSA-N |
Mol Weight | 199.25 g/mol |
Molecular Formula | C13H13NO |
Exact Mass | 199.099714 g/mol |
SpectraBase Spectrum ID | 3HZtWELTEDs |
---|---|
Name | 5,6-Dimethyl-4-phenyl-2-pyridone |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 199.099714042 u |
Formula | C13H13NO |
InChI | InChI=1S/C13H13NO/c1-9-10(2)14-13(15)8-12(9)11-6-4-3-5-7-11/h3-8H,1-2H3,(H,14,15) |
InChIKey | WHKVRBAPEBRGTI-UHFFFAOYSA-N |
Molecular Weight | 199.253 g/mol |
SMILES | C1(=C(NC(C=C1C1=CC=CC=C1)=O)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.854931 |