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Parvisoflavone B

View entire compound with spectra: 1 NMR, and 1 FTIR

Parvisoflavone B
SpectraBase Compound ID JtHFlUPBBjw
InChI InChI=1S/C20H16O6/c1-20(2)6-5-12-15(26-20)8-16-17(18(12)23)19(24)13(9-25-16)11-4-3-10(21)7-14(11)22/h3-9,21-23H,1-2H3
InChIKey YKYNYMQDXOWMDT-UHFFFAOYSA-N
Mol Weight 352.34 g/mol
Molecular Formula C20H16O6
Exact Mass 352.094688 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Gvi3ND7gqBc
Name Parvisoflavone B
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 352.094688229 u
Formula C20H16O6
InChI InChI=1S/C20H16O6/c1-20(2)6-5-12-15(26-20)8-16-17(18(12)23)19(24)13(9-25-16)11-4-3-10(21)7-14(11)22/h3-9,21-23H,1-2H3
InChIKey YKYNYMQDXOWMDT-UHFFFAOYSA-N
Molecular Weight 352.342 g/mol
SMILES C12=C(C(=C3C(=C2)OC=C(C3=O)C2=C(C=C(C=C2)O)O)O)C=CC(O1)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.913181