SpectraBase Compound ID | 32hHh4or29D |
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InChI | InChI=1S/C8H6O3/c9-6-1-2-7-5(3-6)4-11-8(7)10/h1-3,9H,4H2 |
InChIKey | QJEJYBQYGQJKSK-UHFFFAOYSA-N |
Mol Weight | 150.13 g/mol |
Molecular Formula | C8H6O3 |
Exact Mass | 150.031694 g/mol |
SpectraBase Spectrum ID | 6n6OLQ0quQi |
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Name | 5-Hydroxy-2-benzofuran-1(3H)-one |
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/c9-6-1-2-7-5(3-6)4-11-8(7)10/h1-3,9H,4H2 |
InChIKey | QJEJYBQYGQJKSK-UHFFFAOYSA-N |
Molecular Weight | 150.133 g/mol |
SMILES | C1(=O)C2=C(C=C(C=C2)O)CO1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.957749 |