SpectraBase Compound ID | 48dsHXbOqws |
---|---|
InChI | InChI=1S/C10H10O4/c1-12-6-14-8-4-2-3-7-5-13-10(11)9(7)8/h2-4H,5-6H2,1H3 |
InChIKey | AIEBMIXEHMRRFK-UHFFFAOYSA-N |
Mol Weight | 194.19 g/mol |
Molecular Formula | C10H10O4 |
Exact Mass | 194.057909 g/mol |
SpectraBase Spectrum ID | 3rAr1TUQW3Q |
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Name | 7-Methoxymethoxy-3H-isobenzofuran-1-one |
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/c1-12-6-14-8-4-2-3-7-5-13-10(11)9(7)8/h2-4H,5-6H2,1H3 |
InChIKey | AIEBMIXEHMRRFK-UHFFFAOYSA-N |
Molecular Weight | 194.186 g/mol |
SMILES | C1=2C(OCC2C=CC=C1OCOC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.870642 |