SpectraBase Compound ID | 59d2pf2oVue |
---|---|
InChI | InChI=1S/C8H6O3/c9-5-8(11)6-1-3-7(10)4-2-6/h1-5,10H |
InChIKey | MTMONFVFAYLRSG-UHFFFAOYSA-N |
Mol Weight | 150.13 g/mol |
Molecular Formula | C8H6O3 |
Exact Mass | 150.031694 g/mol |
SpectraBase Spectrum ID | JWtiXIyvdDF |
---|---|
Name | (p-Hydroxyphenyl)glyoxal |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 150.031694050 u |
Formula | C8H6O3 |
InChI | InChI=1S/C8H6O3/c9-5-8(11)6-1-3-7(10)4-2-6/h1-5,10H |
InChIKey | MTMONFVFAYLRSG-UHFFFAOYSA-N |
Molecular Weight | 150.133 g/mol |
SMILES | C1=C(C=CC(=C1)O)C(=O)C=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.958518 |