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[2S]-(+)-3',4',5',6'-tetramethoxyisoflavanone

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

[2S]-(+)-3',4',5',6'-tetramethoxyisoflavanone
SpectraBase Compound ID 6mCpPYRDTUs
InChI InChI=1S/C19H20O6/c1-21-15-9-12(17(22-2)19(24-4)18(15)23-3)13-10-25-14-8-6-5-7-11(14)16(13)20/h5-9,13H,10H2,1-4H3/t13-/m1/s1
InChIKey QGWYHURTMSDZEE-CYBMUJFWSA-N
Mol Weight 344.36 g/mol
Molecular Formula C19H20O6
Exact Mass 344.125988 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4VG2vNlWW9h
Name [2S]-(+)-3',4',5',6'-tetramethoxyisoflavanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 344.125988358 u
Formula C19H20O6
InChI InChI=1S/C19H20O6/c1-21-15-9-12(17(22-2)19(24-4)18(15)23-3)13-10-25-14-8-6-5-7-11(14)16(13)20/h5-9,13H,10H2,1-4H3/t13-/m1/s1
InChIKey QGWYHURTMSDZEE-CYBMUJFWSA-N
Molecular Weight 344.363 g/mol
SMILES C1([C@@]2(C(C=3C=CC=CC3OC2)=O)[H])=C(C(OC)=C(C(=C1)OC)OC)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.873475