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Benzamide, 2,6-difluoro-3-methyl-N-(2-phenylethyl)-N-isobutyl-
SpectraBase Compound ID Bm5YorbMVtf
InChI InChI=1S/C20H23F2NO/c1-14(2)13-23(12-11-16-7-5-4-6-8-16)20(24)18-17(21)10-9-15(3)19(18)22/h4-10,14H,11-13H2,1-3H3
InChIKey CILAVTWUJBLEAR-UHFFFAOYSA-N
Mol Weight 331.41 g/mol
Molecular Formula C20H23F2NO
Exact Mass 331.174771 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2j9YVlwKfVi
Name Benzamide, 2,6-difluoro-3-methyl-N-(2-phenylethyl)-N-isobutyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 331.174770690 u
Formula C20H23F2NO
InChI InChI=1S/C20H23F2NO/c1-14(2)13-23(12-11-16-7-5-4-6-8-16)20(24)18-17(21)10-9-15(3)19(18)22/h4-10,14H,11-13H2,1-3H3
InChIKey CILAVTWUJBLEAR-UHFFFAOYSA-N
Molecular Weight 331.407 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)C=1C(=CC=C(C1F)C)F)CC(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.813653