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Phenol, 2-(bromomethyl)-5-methoxy-, acetate
SpectraBase Compound ID 81f1z5zI30V
InChI InChI=1S/C10H11BrO3/c1-7(12)14-10-5-9(13-2)4-3-8(10)6-11/h3-5H,6H2,1-2H3
InChIKey HRMYMSVBBAQEOE-UHFFFAOYSA-N
Mol Weight 259.1 g/mol
Molecular Formula C10H11BrO3
Exact Mass 257.989157 g/mol
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Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3aYtfcmxhP5
Name Phenol, 2-(bromomethyl)-5-methoxy-, acetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 257.989157211 u
Formula C10H11BrO3
InChI InChI=1S/C10H11BrO3/c1-7(12)14-10-5-9(13-2)4-3-8(10)6-11/h3-5H,6H2,1-2H3
InChIKey HRMYMSVBBAQEOE-UHFFFAOYSA-N
Molecular Weight 259.099 g/mol
SMILES COC1=CC=C(C(=C1)OC(C)=O)CBr
Spectrum/Structure Validation Score (Vapor Phase IR) 0.910724
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