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2-(4'-Bromo-2'-hexyloxyphenoxy)-ethan-1-ol

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

2-(4'-Bromo-2'-hexyloxyphenoxy)-ethan-1-ol
SpectraBase Compound ID RwBrESv2SG
InChI InChI=1S/C14H21BrO3/c1-2-3-4-5-9-17-14-11-12(15)6-7-13(14)18-10-8-16/h6-7,11,16H,2-5,8-10H2,1H3
InChIKey UVUWGBSRWNYGGU-UHFFFAOYSA-N
Mol Weight 317.22 g/mol
Molecular Formula C14H21BrO3
Exact Mass 316.067408 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6qwHtGktEjN
Name 2-(4'-Bromo-2'-hexyloxyphenoxy)-ethan-1-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 316.067407533 u
Formula C14H21BrO3
InChI InChI=1S/C14H21BrO3/c1-2-3-4-5-9-17-14-11-12(15)6-7-13(14)18-10-8-16/h6-7,11,16H,2-5,8-10H2,1H3
InChIKey UVUWGBSRWNYGGU-UHFFFAOYSA-N
Molecular Weight 317.223 g/mol
SMILES C1(=CC(Br)=CC=C1OCCO)OCCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.961668