SpectraBase Compound ID | 5MWaCuRqKPU |
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InChI | InChI=1S/C10H10O4/c1-12-6-3-8(13-2)10-7(11)5-14-9(10)4-6/h3-4H,5H2,1-2H3 |
InChIKey | LXQJNUVFRZIYBH-UHFFFAOYSA-N |
Mol Weight | 194.19 g/mol |
Molecular Formula | C10H10O4 |
Exact Mass | 194.057909 g/mol |
SpectraBase Spectrum ID | IuLepabDNyf |
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Name | 4,6-Dimethoxy-3(2H)-benzofuranone |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 194.057908798 u |
Formula | C10H10O4 |
InChI | InChI=1S/C10H10O4/c1-12-6-3-8(13-2)10-7(11)5-14-9(10)4-6/h3-4H,5H2,1-2H3 |
InChIKey | LXQJNUVFRZIYBH-UHFFFAOYSA-N |
Molecular Weight | 194.186 g/mol |
SMILES | C1(=O)COC=2C1=C(C=C(C2)OC)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.952184 |