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Benzamide, 2,6-difluoro-3-methyl-N-benzyl-N-decyl-
SpectraBase Compound ID 6ajdp9lTIwO
InChI InChI=1S/C25H33F2NO/c1-3-4-5-6-7-8-9-13-18-28(19-21-14-11-10-12-15-21)25(29)23-22(26)17-16-20(2)24(23)27/h10-12,14-17H,3-9,13,18-19H2,1-2H3
InChIKey ZABODLCZZKBTOC-UHFFFAOYSA-N
Mol Weight 401.5 g/mol
Molecular Formula C25H33F2NO
Exact Mass 401.253021 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3IPVcD8RsVq
Name Benzamide, 2,6-difluoro-3-methyl-N-benzyl-N-decyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 401.253021012 u
Formula C25H33F2NO
InChI InChI=1S/C25H33F2NO/c1-3-4-5-6-7-8-9-13-18-28(19-21-14-11-10-12-15-21)25(29)23-22(26)17-16-20(2)24(23)27/h10-12,14-17H,3-9,13,18-19H2,1-2H3
InChIKey ZABODLCZZKBTOC-UHFFFAOYSA-N
Molecular Weight 401.542 g/mol
SMILES C(N(CCCCCCCCCC)CC1=CC=CC=C1)(=O)C=1C(F)=C(C=CC1F)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.800792