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Benzamide, 4-chloro-N-butyl-N-octadecyl-

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

Benzamide, 4-chloro-N-butyl-N-octadecyl-
SpectraBase Compound ID CDbfMti78Nn
InChI InChI=1S/C29H50ClNO/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26-31(25-6-4-2)29(32)27-21-23-28(30)24-22-27/h21-24H,3-20,25-26H2,1-2H3
InChIKey PTRFTZWUCUPNBS-UHFFFAOYSA-N
Mol Weight 464.2 g/mol
Molecular Formula C29H50ClNO
Exact Mass 463.358093 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DM7ag26X3Gj
Name Benzamide, 4-chloro-N-butyl-N-octadecyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 463.358092933 u
Formula C29H50ClNO
InChI InChI=1S/C29H50ClNO/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26-31(25-6-4-2)29(32)27-21-23-28(30)24-22-27/h21-24H,3-20,25-26H2,1-2H3
InChIKey PTRFTZWUCUPNBS-UHFFFAOYSA-N
Molecular Weight 464.178 g/mol
SMILES C(=O)(N(CCCC)CCCCCCCCCCCCCCCCCC)C=1C=CC(=CC1)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.846646