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Methyl 6-oxo-6H-[1,3]dioxolo[4,5-g]chromene-8-carboxylate
SpectraBase Compound ID AEftfV8j2jF
InChI InChI=1S/C12H8O6/c1-15-12(14)7-3-11(13)18-8-4-10-9(2-6(7)8)16-5-17-10/h2-4H,5H2,1H3
InChIKey OQNHDXRFUWTPBK-UHFFFAOYSA-N
Mol Weight 248.19 g/mol
Molecular Formula C12H8O6
Exact Mass 248.032088 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KqNhgDPoWHq
Name Methyl 6-oxo-6H-[1,3]dioxolo[4,5-G]chromene-8-carboxylate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 248.032087972 u
Formula C12H8O6
InChI InChI=1S/C12H8O6/c1-15-12(14)7-3-11(13)18-8-4-10-9(2-6(7)8)16-5-17-10/h2-4H,5H2,1H3
InChIKey OQNHDXRFUWTPBK-UHFFFAOYSA-N
Molecular Weight 248.190 g/mol
SMILES C=1(C2=C(C=C3C(=C2)OCO3)OC(C1)=O)C(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.904828