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Methyl 3-(4-hydroxyphenyl)-6-methyl-4-oxo-2H,3H-furo[3,2-C]pyran-2-carboxylate
SpectraBase Compound ID 7bUMs5Eu8MV
InChI InChI=1S/C16H14O6/c1-8-7-11-13(15(18)21-8)12(14(22-11)16(19)20-2)9-3-5-10(17)6-4-9/h3-7,12,14,17H,1-2H3
InChIKey YNMDEEIJGDFDRK-UHFFFAOYSA-N
Mol Weight 302.28 g/mol
Molecular Formula C16H14O6
Exact Mass 302.079038 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JZi3jlBp0jb
Name Methyl 3-(4-hydroxyphenyl)-6-methyl-4-oxo-2H,3H-furo[3,2-C]pyran-2-carboxylate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 302.079038165 u
Formula C16H14O6
InChI InChI=1S/C16H14O6/c1-8-7-11-13(15(18)21-8)12(14(22-11)16(19)20-2)9-3-5-10(17)6-4-9/h3-7,12,14,17H,1-2H3
InChIKey YNMDEEIJGDFDRK-UHFFFAOYSA-N
Molecular Weight 302.282 g/mol
SMILES C1(=CC=C(C2C(C(OC)=O)OC3=C2C(OC(C)=C3)=O)C=C1)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.902335