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3-Bromo-2-oxo-N-[p-methylphenyl]cyclohexanecarboxamide

View entire compound with spectra: 1 FTIR

3-Bromo-2-oxo-N-[p-methylphenyl]cyclohexanecarboxamide
SpectraBase Compound ID 9ntap8WTsAp
InChI InChI=1S/C14H16BrNO2/c1-9-5-7-10(8-6-9)16-14(18)11-3-2-4-12(15)13(11)17/h5-8,11-12H,2-4H2,1H3,(H,16,18)
InChIKey AMTLCWZLEFKPJI-UHFFFAOYSA-N
Mol Weight 310.19 g/mol
Molecular Formula C14H16BrNO2
Exact Mass 309.036442 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FgFxWTLfas7
Name 3-Bromo-2-oxo-N-[p-methylphenyl]cyclohexanecarboxamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 309.036441757 u
Formula C14H16BrNO2
InChI InChI=1S/C14H16BrNO2/c1-9-5-7-10(8-6-9)16-14(18)11-3-2-4-12(15)13(11)17/h5-8,11-12H,2-4H2,1H3,(H,16,18)
InChIKey AMTLCWZLEFKPJI-UHFFFAOYSA-N
Molecular Weight 310.191 g/mol
SMILES C1=C(C=CC(=C1)C)NC(C1C(C(CCC1)Br)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.941077