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Tris(4-bromophenoxy)fluoromethane

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

Tris(4-bromophenoxy)fluoromethane
SpectraBase Compound ID DRUXm2SWYLR
InChI InChI=1S/C19H12Br3FO3/c20-13-1-7-16(8-2-13)24-19(23,25-17-9-3-14(21)4-10-17)26-18-11-5-15(22)6-12-18/h1-12H
InChIKey MYBACSDROKOSLT-UHFFFAOYSA-N
Mol Weight 547.01 g/mol
Molecular Formula C19H12Br3FO3
Exact Mass 543.832061 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID gQNOa52xS2
Name Tris(4-bromophenoxy)fluoromethane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 543.832061406 u
Formula C19H12Br3FO3
InChI InChI=1S/C19H12Br3FO3/c20-13-1-7-16(8-2-13)24-19(23,25-17-9-3-14(21)4-10-17)26-18-11-5-15(22)6-12-18/h1-12H
InChIKey MYBACSDROKOSLT-UHFFFAOYSA-N
Molecular Weight 547.012 g/mol
SMILES C(OC1=CC=C(C=C1)Br)(OC=1C=CC(=CC1)Br)(OC=1C=CC(=CC1)Br)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.934903