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3-Hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-methoxy-4H-chromen-4-one
SpectraBase Compound ID KUfz78NCgRb
InChI InChI=1S/C17H14O6/c1-21-10-4-5-11-14(8-10)23-17(16(20)15(11)19)9-3-6-13(22-2)12(18)7-9/h3-8,18,20H,1-2H3
InChIKey LSCPEQZEOMKWEF-UHFFFAOYSA-N
Mol Weight 314.29 g/mol
Molecular Formula C17H14O6
Exact Mass 314.079038 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4HyEy95w8rG
Name 3-Hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-methoxy-4H-chromen-4-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 314.079038165 u
Formula C17H14O6
InChI InChI=1S/C17H14O6/c1-21-10-4-5-11-14(8-10)23-17(16(20)15(11)19)9-3-6-13(22-2)12(18)7-9/h3-8,18,20H,1-2H3
InChIKey LSCPEQZEOMKWEF-UHFFFAOYSA-N
Molecular Weight 314.293 g/mol
SMILES C12=C(OC(=C(C2=O)O)C2=CC(=C(OC)C=C2)O)C=C(C=C1)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.825126