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5-Methoxy-6-[1-[4-methylphenyl]ethyl]-1,3-benzodioxole

View entire compound with spectra: 1 FTIR

5-Methoxy-6-[1-[4-methylphenyl]ethyl]-1,3-benzodioxole
SpectraBase Compound ID LobJQut28zx
InChI InChI=1S/C17H18O3/c1-11-4-6-13(7-5-11)12(2)14-8-16-17(20-10-19-16)9-15(14)18-3/h4-9,12H,10H2,1-3H3
InChIKey FAMMEBNJNOSMLA-UHFFFAOYSA-N
Mol Weight 270.33 g/mol
Molecular Formula C17H18O3
Exact Mass 270.125594 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1kNFUYcrYqn
Name 5-Methoxy-6-[1-[4-methylphenyl]ethyl]-1,3-benzodioxole
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 270.125594437 u
Formula C17H18O3
InChI InChI=1S/C17H18O3/c1-11-4-6-13(7-5-11)12(2)14-8-16-17(20-10-19-16)9-15(14)18-3/h4-9,12H,10H2,1-3H3
InChIKey FAMMEBNJNOSMLA-UHFFFAOYSA-N
SMILES C1(=C(C=C2C(=C1)OCO2)OC)C(C1=CC=C(C=C1)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.959282