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2-Bromoethyl alpha,alpha,alpha-trifluoro-m-tolyl ether; benzene, 1-(2-bromoethoxy)-3-(trifluoromethyl)-; phenetole, beta-bromo-m-(trifluoromethyl)-

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 Raman

2-Bromoethyl alpha,alpha,alpha-trifluoro-m-tolyl ether; benzene, 1-(2-bromoethoxy)-3-(trifluoromethyl)-; phenetole, beta-bromo-m-(trifluoromethyl)-
SpectraBase Compound ID DnHHXyeh7XK
InChI InChI=1S/C9H8BrF3O/c10-4-5-14-8-3-1-2-7(6-8)9(11,12)13/h1-3,6H,4-5H2
InChIKey NZOCBKYAZHDTDD-UHFFFAOYSA-N
Mol Weight 269.06 g/mol
Molecular Formula C9H8BrF3O
Exact Mass 267.971062 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID LdQPWFudkY
Name 2-Bromoethyl alpha,alpha,alpha-trifluoro-m-tolyl ether; benzene, 1-(2-bromoethoxy)-3-(trifluoromethyl)-; phenetole, beta-bromo-m-(trifluoromethyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 267.971062366 u
Formula C9H8BrF3O
InChI InChI=1S/C9H8BrF3O/c10-4-5-14-8-3-1-2-7(6-8)9(11,12)13/h1-3,6H,4-5H2
InChIKey NZOCBKYAZHDTDD-UHFFFAOYSA-N
Molecular Weight 269.061 g/mol
SMILES C1(=CC=CC(=C1)C(F)(F)F)OCCBr
Spectrum/Structure Validation Score (Raman) 0.984952