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4-Bromo-2-methoxybenzyl alcohol, 2-methylpropyl ether

View entire compound with spectra: 1 FTIR

4-Bromo-2-methoxybenzyl alcohol, 2-methylpropyl ether
SpectraBase Compound ID 9zTHEe4eyNP
InChI InChI=1S/C12H17BrO2/c1-9(2)7-15-8-10-4-5-11(13)6-12(10)14-3/h4-6,9H,7-8H2,1-3H3
InChIKey VPFUSYRFOJOPCA-UHFFFAOYSA-N
Mol Weight 273.17 g/mol
Molecular Formula C12H17BrO2
Exact Mass 272.041193 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EB1XYrykR73
Name 4-Bromo-2-methoxybenzyl alcohol, 2-methylpropyl ether
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 272.041192785 u
Formula C12H17BrO2
InChI InChI=1S/C12H17BrO2/c1-9(2)7-15-8-10-4-5-11(13)6-12(10)14-3/h4-6,9H,7-8H2,1-3H3
InChIKey VPFUSYRFOJOPCA-UHFFFAOYSA-N
Molecular Weight 273.170 g/mol
SMILES C1=C(C(=CC(=C1)Br)OC)COCC(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.915066