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2-(Hydroxymethyl)-1-(3,4-methylenedioxyphenyl)-6,7-dimethoxynaphthalene
SpectraBase Compound ID FnT4oKq4uhT
InChI InChI=1S/C20H18O5/c1-22-17-7-12-3-4-14(10-21)20(15(12)9-18(17)23-2)13-5-6-16-19(8-13)25-11-24-16/h3-9,21H,10-11H2,1-2H3
InChIKey JLZXMMWEWDJJRS-UHFFFAOYSA-N
Mol Weight 338.36 g/mol
Molecular Formula C20H18O5
Exact Mass 338.115424 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2GtJ5eZ2vVy
Name 2-(Hydroxymethyl)-1-(3,4-methylenedioxyphenyl)-6,7-dimethoxynaphthalene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 338.115423675 u
Formula C20H18O5
InChI InChI=1S/C20H18O5/c1-22-17-7-12-3-4-14(10-21)20(15(12)9-18(17)23-2)13-5-6-16-19(8-13)25-11-24-16/h3-9,21H,10-11H2,1-2H3
InChIKey JLZXMMWEWDJJRS-UHFFFAOYSA-N
Molecular Weight 338.359 g/mol
SMILES C=1(C(=CC=C2C=C(C(=CC12)OC)OC)CO)C=1C=C2C(=CC1)OCO2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.902283