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Licorisoflavan-A;3',6-diprenyl-2',4'-dihydroxy-5,7-dimethoxyisoflavan
SpectraBase Compound ID 2rjEgw0S8jQ
InChI InChI=1S/C27H34O5/c1-16(2)7-9-20-23(28)12-11-19(26(20)29)18-13-22-25(32-15-18)14-24(30-5)21(27(22)31-6)10-8-17(3)4/h7-8,11-12,14,18,28-29H,9-10,13,15H2,1-6H3
InChIKey GDAAEAXMNLVRCZ-UHFFFAOYSA-N
Mol Weight 438.6 g/mol
Molecular Formula C27H34O5
Exact Mass 438.240624 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FSlb1ukBC6m
Name Licorisoflavan-A;3',6-diprenyl-2',4'-dihydroxy-5,7-dimethoxyisoflavan
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 438.240624190 u
Formula C27H34O5
InChI InChI=1S/C27H34O5/c1-16(2)7-9-20-23(28)12-11-19(26(20)29)18-13-22-25(32-15-18)14-24(30-5)21(27(22)31-6)10-8-17(3)4/h7-8,11-12,14,18,28-29H,9-10,13,15H2,1-6H3
InChIKey GDAAEAXMNLVRCZ-UHFFFAOYSA-N
Molecular Weight 438.564 g/mol
SMILES C1(OC)=CC=2OCC(C3=CC=C(O)C(CC=C(C)C)=C3O)CC2C(OC)=C1CC=C(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.828944