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1-(3,4-Methylenedioxyphenyl)-1,3-dimethoxypropane

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

1-(3,4-Methylenedioxyphenyl)-1,3-dimethoxypropane
SpectraBase Compound ID Dor93xYb4Fr
InChI InChI=1S/C12H16O4/c1-13-6-5-10(14-2)9-3-4-11-12(7-9)16-8-15-11/h3-4,7,10H,5-6,8H2,1-2H3
InChIKey VOZSCGCMLWLARD-UHFFFAOYSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5WCpWZnlxy1
Name 1-(3,4-Methylenedioxyphenyl)-1,3-dimethoxypropane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 224.104858991 u
Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-13-6-5-10(14-2)9-3-4-11-12(7-9)16-8-15-11/h3-4,7,10H,5-6,8H2,1-2H3
InChIKey VOZSCGCMLWLARD-UHFFFAOYSA-N
Molecular Weight 224.256 g/mol
SMILES C(CCOC)(OC)C1=CC2=C(C=C1)OCO2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.963699