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1-[(4-Bromo-2-fluorophenyl)carbonyl]pyrrolidine

View entire compound with spectra: 1 FTIR

1-[(4-Bromo-2-fluorophenyl)carbonyl]pyrrolidine
SpectraBase Compound ID FRlJPqem6qV
InChI InChI=1S/C11H11BrFNO/c12-8-3-4-9(10(13)7-8)11(15)14-5-1-2-6-14/h3-4,7H,1-2,5-6H2
InChIKey PKLITRNXVHIMJL-UHFFFAOYSA-N
Mol Weight 272.12 g/mol
Molecular Formula C11H11BrFNO
Exact Mass 271.000805 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HxOw0FN71E6
Name 1-[(4-Bromo-2-fluorophenyl)carbonyl]pyrrolidine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 271.000805140 u
Formula C11H11BrFNO
InChI InChI=1S/C11H11BrFNO/c12-8-3-4-9(10(13)7-8)11(15)14-5-1-2-6-14/h3-4,7H,1-2,5-6H2
InChIKey PKLITRNXVHIMJL-UHFFFAOYSA-N
Molecular Weight 272.117 g/mol
SMILES C(=O)(C1=C(F)C=C(C=C1)Br)N1CCCC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.890761