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Glutaric acid, monoamide, N-(2-octyl)-, tridecyl ester

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

Glutaric acid, monoamide, N-(2-octyl)-, tridecyl ester
SpectraBase Compound ID BXPHQWd9QZa
InChI InChI=1S/C26H51NO3/c1-4-6-8-10-11-12-13-14-15-16-18-23-30-26(29)22-19-21-25(28)27-24(3)20-17-9-7-5-2/h24H,4-23H2,1-3H3,(H,27,28)
InChIKey CKNMTUAGGPAZCO-UHFFFAOYSA-N
Mol Weight 425.7 g/mol
Molecular Formula C26H51NO3
Exact Mass 425.386895 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HlO5zZiH5hU
Name Glutaric acid, monoamide, N-(2-octyl)-, tridecyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 425.386894503 u
Formula C26H51NO3
InChI InChI=1S/C26H51NO3/c1-4-6-8-10-11-12-13-14-15-16-18-23-30-26(29)22-19-21-25(28)27-24(3)20-17-9-7-5-2/h24H,4-23H2,1-3H3,(H,27,28)
InChIKey CKNMTUAGGPAZCO-UHFFFAOYSA-N
Molecular Weight 425.698 g/mol
SMILES CC(NC(CCCC(OCCCCCCCCCCCCC)=O)=O)CCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.95408