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4-Bromo-3-trifluoromethylacetanilide
SpectraBase Compound ID LVpqibiTXR7
InChI InChI=1S/C9H7BrF3NO/c1-5(15)14-6-2-3-8(10)7(4-6)9(11,12)13/h2-4H,1H3,(H,14,15)
InChIKey AOHSBSXIGFIMNC-UHFFFAOYSA-N
Mol Weight 282.06 g/mol
Molecular Formula C9H7BrF3NO
Exact Mass 280.966311 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DG1h4RyrYmX
Name 4-Bromo-3-trifluoromethylacetanilide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 280.966311337 u
Formula C9H7BrF3NO
InChI InChI=1S/C9H7BrF3NO/c1-5(15)14-6-2-3-8(10)7(4-6)9(11,12)13/h2-4H,1H3,(H,14,15)
InChIKey AOHSBSXIGFIMNC-UHFFFAOYSA-N
Molecular Weight 282.060 g/mol
SMILES C(F)(F)(F)C1=C(C=CC(=C1)NC(=O)C)Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.829839