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Benzamide, 3-chloro-2-fluoro-N-benzyl-N-pentyl-

View entire compound with spectra: 1 FTIR

Benzamide, 3-chloro-2-fluoro-N-benzyl-N-pentyl-
SpectraBase Compound ID 5dLmM7cgub9
InChI InChI=1S/C19H21ClFNO/c1-2-3-7-13-22(14-15-9-5-4-6-10-15)19(23)16-11-8-12-17(20)18(16)21/h4-6,8-12H,2-3,7,13-14H2,1H3
InChIKey LHQOMAAUCQXROW-UHFFFAOYSA-N
Mol Weight 333.83 g/mol
Molecular Formula C19H21ClFNO
Exact Mass 333.12957 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 16oXGRg6PnG
Name Benzamide, 3-chloro-2-fluoro-N-benzyl-N-pentyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 333.129570162 u
Formula C19H21ClFNO
InChI InChI=1S/C19H21ClFNO/c1-2-3-7-13-22(14-15-9-5-4-6-10-15)19(23)16-11-8-12-17(20)18(16)21/h4-6,8-12H,2-3,7,13-14H2,1H3
InChIKey LHQOMAAUCQXROW-UHFFFAOYSA-N
Molecular Weight 333.834 g/mol
SMILES C(N(CCCCC)CC1=CC=CC=C1)(=O)C=1C(F)=C(C=CC1)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.81878