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Durallone;3-(3,4-dimethoxyphenyl)-6-methoxy-8,8-dimethyl-4H,8H-benzo-[1,2-B:3,4-B']-dipyran-4-one
SpectraBase Compound ID KdrTVzALlxU
InChI InChI=1S/C23H22O6/c1-23(2)9-8-14-21-15(11-19(27-5)22(14)29-23)20(24)16(12-28-21)13-6-7-17(25-3)18(10-13)26-4/h6-12H,1-5H3
InChIKey VMYJORXFBILIJU-UHFFFAOYSA-N
Mol Weight 394.42 g/mol
Molecular Formula C23H22O6
Exact Mass 394.141638 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KOZHauXucsB
Name Durallone;3-(3,4-dimethoxyphenyl)-6-methoxy-8,8-dimethyl-4H,8H-benzo-[1,2-B:3,4-B']-dipyran-4-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 394.141638422 u
Formula C23H22O6
InChI InChI=1S/C23H22O6/c1-23(2)9-8-14-21-15(11-19(27-5)22(14)29-23)20(24)16(12-28-21)13-6-7-17(25-3)18(10-13)26-4/h6-12H,1-5H3
InChIKey VMYJORXFBILIJU-UHFFFAOYSA-N
Molecular Weight 394.423 g/mol
SMILES C1(=O)C(=COC=2C1=CC(=C1C2C=CC(O1)(C)C)OC)C1=CC(=C(C=C1)OC)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.815665