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2-(Benzyloxy)-5-bromo-1-trifluoromethylbenzene

View entire compound with spectra: 1 FTIR

2-(Benzyloxy)-5-bromo-1-trifluoromethylbenzene
SpectraBase Compound ID 1f7CB3QZ2gN
InChI InChI=1S/C14H10BrF3O/c15-11-6-7-13(12(8-11)14(16,17)18)19-9-10-4-2-1-3-5-10/h1-8H,9H2
InChIKey QTPKEFVNEOEGGH-UHFFFAOYSA-N
Mol Weight 331.13 g/mol
Molecular Formula C14H10BrF3O
Exact Mass 329.986712 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3WXigrBqWv5
Name 2-(Benzyloxy)-5-bromo-1-trifluoromethylbenzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 329.986712430 u
Formula C14H10BrF3O
InChI InChI=1S/C14H10BrF3O/c15-11-6-7-13(12(8-11)14(16,17)18)19-9-10-4-2-1-3-5-10/h1-8H,9H2
InChIKey QTPKEFVNEOEGGH-UHFFFAOYSA-N
Molecular Weight 331.132 g/mol
SMILES C(F)(F)(F)C1=C(C=CC(=C1)Br)OCC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.93094