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Benzamide, 4-bromo-N-benzyl-N-undecyl-

View entire compound with spectra: 1 NMR, and 1 FTIR

Benzamide, 4-bromo-N-benzyl-N-undecyl-
SpectraBase Compound ID KXltyPjzicp
InChI InChI=1S/C25H34BrNO/c1-2-3-4-5-6-7-8-9-13-20-27(21-22-14-11-10-12-15-22)25(28)23-16-18-24(26)19-17-23/h10-12,14-19H,2-9,13,20-21H2,1H3
InChIKey XRHJCNANKXEHFF-UHFFFAOYSA-N
Mol Weight 444.5 g/mol
Molecular Formula C25H34BrNO
Exact Mass 443.182378 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AZvIX8JLOzH
Name Benzamide, 4-bromo-N-benzyl-N-undecyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 443.182377718 u
Formula C25H34BrNO
InChI InChI=1S/C25H34BrNO/c1-2-3-4-5-6-7-8-9-13-20-27(21-22-14-11-10-12-15-22)25(28)23-16-18-24(26)19-17-23/h10-12,14-19H,2-9,13,20-21H2,1H3
InChIKey XRHJCNANKXEHFF-UHFFFAOYSA-N
Molecular Weight 444.457 g/mol
SMILES C(N(CCCCCCCCCCC)CC1=CC=CC=C1)(=O)C=1C=CC(=CC1)Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.817952