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N-(4-bromo-2-fluorophenyl)cyclopentanecarboxamide
SpectraBase Compound ID Lo36p9y49TG
InChI InChI=1S/C12H13BrFNO/c13-9-5-6-11(10(14)7-9)15-12(16)8-3-1-2-4-8/h5-8H,1-4H2,(H,15,16)
InChIKey HQTSJBZYDBSZBM-UHFFFAOYSA-N
Mol Weight 286.14 g/mol
Molecular Formula C12H13BrFNO
Exact Mass 285.016455 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JaryY7f8OT1
Name N-(4-Bromo-2-fluorophenyl)cyclopentanecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 285.016455205 u
Formula C12H13BrFNO
InChI InChI=1S/C12H13BrFNO/c13-9-5-6-11(10(14)7-9)15-12(16)8-3-1-2-4-8/h5-8H,1-4H2,(H,15,16)
InChIKey HQTSJBZYDBSZBM-UHFFFAOYSA-N
Molecular Weight 286.144 g/mol
SMILES N(C=1C(=CC(=CC1)Br)F)C(=O)C1CCCC1