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N-T-Butyl 2-bromo-5-fluorobenzamide

View entire compound with spectra: 1 FTIR

N-T-Butyl 2-bromo-5-fluorobenzamide
SpectraBase Compound ID F7su9GNIRkA
InChI InChI=1S/C11H13BrFNO/c1-11(2,3)14-10(15)8-6-7(13)4-5-9(8)12/h4-6H,1-3H3,(H,14,15)
InChIKey SSXSKZCGJIFORU-UHFFFAOYSA-N
Mol Weight 274.13 g/mol
Molecular Formula C11H13BrFNO
Exact Mass 273.016455 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID ClkthISnkuO
Name N-T-Butyl 2-bromo-5-fluorobenzamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 273.016455205 u
Formula C11H13BrFNO
InChI InChI=1S/C11H13BrFNO/c1-11(2,3)14-10(15)8-6-7(13)4-5-9(8)12/h4-6H,1-3H3,(H,14,15)
InChIKey SSXSKZCGJIFORU-UHFFFAOYSA-N
Molecular Weight 274.133 g/mol
SMILES C1(F)=CC(=C(C=C1)Br)C(=O)NC(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.89475