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3-(3'-Methylbut-2'-enyl)-1,2-dimethoxybenzene

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

3-(3'-Methylbut-2'-enyl)-1,2-dimethoxybenzene
SpectraBase Compound ID HGlwvV06Re1
InChI InChI=1S/C13H18O2/c1-10(2)8-9-11-6-5-7-12(14-3)13(11)15-4/h5-8H,9H2,1-4H3
InChIKey WHUMGWKZYWNAPG-UHFFFAOYSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DLULWeW6C3I
Name 3-(3'-Methylbut-2'-enyl)-1,2-dimethoxybenzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 206.130679818 u
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-10(2)8-9-11-6-5-7-12(14-3)13(11)15-4/h5-8H,9H2,1-4H3
InChIKey WHUMGWKZYWNAPG-UHFFFAOYSA-N
Molecular Weight 206.285 g/mol
SMILES C1(=C(CC=C(C)C)C=CC=C1OC)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.813511