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1,3-Benzodioxole, 5-(1-(4-ethoxyphenyl)ethyl)-6-methoxy-

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

1,3-Benzodioxole, 5-(1-(4-ethoxyphenyl)ethyl)-6-methoxy-
SpectraBase Compound ID JfjQQKHDV9r
InChI InChI=1S/C18H20O4/c1-4-20-14-7-5-13(6-8-14)12(2)15-9-17-18(22-11-21-17)10-16(15)19-3/h5-10,12H,4,11H2,1-3H3
InChIKey HEPVVPUNSAKITO-UHFFFAOYSA-N
Mol Weight 300.35 g/mol
Molecular Formula C18H20O4
Exact Mass 300.136159 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AUjHocU3Mmk
Name 1,3-Benzodioxole, 5-(1-(4-ethoxyphenyl)ethyl)-6-methoxy-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 300.136159120 u
Formula C18H20O4
InChI InChI=1S/C18H20O4/c1-4-20-14-7-5-13(6-8-14)12(2)15-9-17-18(22-11-21-17)10-16(15)19-3/h5-10,12H,4,11H2,1-3H3
InChIKey HEPVVPUNSAKITO-UHFFFAOYSA-N
Molecular Weight 300.354 g/mol
SMILES C1=C(C(=CC2=C1OCO2)OC)C(C)C1=CC=C(C=C1)OCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.929389