| SpectraBase Spectrum ID |
40Ek8FoNIro |
| Name |
1-[2-oxo-2-(3,4,5-Trimethoxyphenyl)ethyl]-2(1H)-pyridinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
303.110672646 u |
| Formula |
C16H17NO5 |
| InChI |
InChI=1S/C16H17NO5/c1-20-13-8-11(9-14(21-2)16(13)22-3)12(18)10-17-7-5-4-6-15(17)19/h4-9H,10H2,1-3H3 |
| InChIKey |
PRYRCFMPBMJIGG-UHFFFAOYSA-N |
| SMILES |
C1=C(C(=C(C=C1C(=O)CN1C(C=CC=C1)=O)OC)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.946525 |