SpectraBase Compound ID | Jq4WaTb7ol7 |
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InChI | InChI=1S/C13H10O4/c14-10-7-6-9(12(16)13(10)17)11(15)8-4-2-1-3-5-8/h1-7,14,16-17H |
InChIKey | HTQNYBBTZSBWKL-UHFFFAOYSA-N |
Mol Weight | 230.22 g/mol |
Molecular Formula | C13H10O4 |
Exact Mass | 230.057909 g/mol |
SpectraBase Spectrum ID | qaedKChAOS |
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Name | 2,3,4-Trihydroxybenzophenone |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 230.057908798 u |
Formula | C13H10O4 |
InChI | InChI=1S/C13H10O4/c14-10-7-6-9(12(16)13(10)17)11(15)8-4-2-1-3-5-8/h1-7,14,16-17H |
InChIKey | HTQNYBBTZSBWKL-UHFFFAOYSA-N |
Molecular Weight | 230.219 g/mol |
SMILES | C(=O)(C=1C=CC=CC1)C1=C(O)C(O)=C(O)C=C1 |
Spectrum/Structure Validation Score (Raman) | 0.938283 |