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(+/-)-2-(3,4-dimethoxyphenyl)-3-methyl-7-methoxy-5-[(E)-1-propenyl]-2,3-dihydrobenzo-[B]-furan
SpectraBase Compound ID DWf6gX2UPGU
InChI InChI=1S/C21H24O4/c1-6-7-14-10-16-13(2)20(25-21(16)19(11-14)24-5)15-8-9-17(22-3)18(12-15)23-4/h6-13,20H,1-5H3/b7-6+/t13?,20-/m1/s1
InChIKey ITFKWUHXYCXXFF-WOUULEKRSA-N
Mol Weight 340.42 g/mol
Molecular Formula C21H24O4
Exact Mass 340.167459 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1HGJP4d0sYp
Name (+/-)-2-(3,4-dimethoxyphenyl)-3-methyl-7-methoxy-5-[(E)-1-propenyl]-2,3-dihydrobenzo-[B]-furan
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 340.167459249 u
Formula C21H24O4
InChI InChI=1S/C21H24O4/c1-6-7-14-10-16-13(2)20(25-21(16)19(11-14)24-5)15-8-9-17(22-3)18(12-15)23-4/h6-13,20H,1-5H3/b7-6+/t13?,20-/m1/s1
InChIKey ITFKWUHXYCXXFF-WOUULEKRSA-N
Molecular Weight 340.419 g/mol
SMILES [C@@]1(OC2=C(C=C(C=C2C1C)\C=C\C)OC)(C1=CC(=C(C=C1)OC)OC)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.937964