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Methyl-3-methyl-1,4-benzodioxin-2-carboxylate

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

Methyl-3-methyl-1,4-benzodioxin-2-carboxylate
SpectraBase Compound ID IyDq0wrybw0
InChI InChI=1S/C11H10O4/c1-7-10(11(12)13-2)15-9-6-4-3-5-8(9)14-7/h3-6H,1-2H3
InChIKey GXTKBBDXUJXPMD-UHFFFAOYSA-N
Mol Weight 206.2 g/mol
Molecular Formula C11H10O4
Exact Mass 206.057909 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8E9KJ7IvFYA
Name Methyl-3-methyl-1,4-benzodioxin-2-carboxylate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 206.057908798 u
Formula C11H10O4
InChI InChI=1S/C11H10O4/c1-7-10(11(12)13-2)15-9-6-4-3-5-8(9)14-7/h3-6H,1-2H3
InChIKey GXTKBBDXUJXPMD-UHFFFAOYSA-N
Molecular Weight 206.197 g/mol
SMILES C=1(OC=2C(OC1C)=CC=CC2)C(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.915485