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6-Bromo-2'-fluoro-4'-iodo-m-anisanilide

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

6-Bromo-2'-fluoro-4'-iodo-m-anisanilide
SpectraBase Compound ID IM6DIZ4ZzO1
InChI InChI=1S/C14H10BrFINO2/c1-20-9-3-4-11(15)10(7-9)14(19)18-13-5-2-8(17)6-12(13)16/h2-7H,1H3,(H,18,19)
InChIKey ZGVGYIYWJGLOMA-UHFFFAOYSA-N
Mol Weight 450.05 g/mol
Molecular Formula C14H10BrFINO2
Exact Mass 448.892365 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID Lf5GSlMeQKA
Name 6-Bromo-2'-fluoro-4'-iodo-m-anisanilide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 448.892364727 u
Formula C14H10BrFINO2
InChI InChI=1S/C14H10BrFINO2/c1-20-9-3-4-11(15)10(7-9)14(19)18-13-5-2-8(17)6-12(13)16/h2-7H,1H3,(H,18,19)
InChIKey ZGVGYIYWJGLOMA-UHFFFAOYSA-N
Molecular Weight 450.046 g/mol
SMILES N(C1=CC=C(C=C1F)I)C(C=1C(=CC=C(C1)OC)Br)=O
Spectrum/Structure Validation Score (Raman) 0.796538