| SpectraBase Spectrum ID |
4qbLMuQfulz |
| Name |
4(1H)-Pyridinone, 2-[2-(hydroxymethyl)benzoyl]-1-methyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
243.089543280 u |
| Formula |
C14H13NO3 |
| InChI |
InChI=1S/C14H13NO3/c1-15-7-6-11(17)8-13(15)14(18)12-5-3-2-4-10(12)9-16/h2-8,16H,9H2,1H3 |
| InChIKey |
QEYTVBJSRUCPDP-UHFFFAOYSA-N |
| Molecular Weight |
243.262 g/mol |
| SMILES |
C=1(C(C=2C(CO)=CC=CC2)=O)N(C=CC(C1)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.925763 |
![4(1H)-Pyridinone, 2-[2-(hydroxymethyl)benzoyl]-1-methyl-](/api/spectrum/4qbLMuQfulz/structure.png?h=300&w=458 "4(1H)-Pyridinone, 2-[2-(hydroxymethyl)benzoyl]-1-methyl-")
