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N-Cyclohexyl-4,4-difluoro-2-(4-methylphenyl)-2-methylbutanamide
SpectraBase Compound ID FPeKA1fWWai
InChI InChI=1S/C18H25F2NO/c1-13-8-10-14(11-9-13)18(2,12-16(19)20)17(22)21-15-6-4-3-5-7-15/h8-11,15-16H,3-7,12H2,1-2H3,(H,21,22)
InChIKey NTLQYTATFXVOLT-UHFFFAOYSA-N
Mol Weight 309.4 g/mol
Molecular Formula C18H25F2NO
Exact Mass 309.190421 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7ova29qQLr4
Name N-Cyclohexyl-4,4-difluoro-2-(4-methylphenyl)-2-methylbutanamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 309.190420754 u
Formula C18H25F2NO
InChI InChI=1S/C18H25F2NO/c1-13-8-10-14(11-9-13)18(2,12-16(19)20)17(22)21-15-6-4-3-5-7-15/h8-11,15-16H,3-7,12H2,1-2H3,(H,21,22)
InChIKey NTLQYTATFXVOLT-UHFFFAOYSA-N
Molecular Weight 309.401 g/mol
SMILES C(CC(F)F)(C)(C1=CC=C(C=C1)C)C(=O)NC1CCCCC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.94625