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Glutaric acid, monoamide, N-(3-pentyl)-, butyl ester

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Glutaric acid, monoamide, N-(3-pentyl)-, butyl ester
SpectraBase Compound ID 8Cx3lniTg8f
InChI InChI=1S/C14H27NO3/c1-4-7-11-18-14(17)10-8-9-13(16)15-12(5-2)6-3/h12H,4-11H2,1-3H3,(H,15,16)
InChIKey RMHYACMHJPHUDN-UHFFFAOYSA-N
Mol Weight 257.37 g/mol
Molecular Formula C14H27NO3
Exact Mass 257.199094 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DBYhcDD6htl
Name Glutaric acid, monoamide, N-(3-pentyl)-, butyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 257.199093730 u
Formula C14H27NO3
InChI InChI=1S/C14H27NO3/c1-4-7-11-18-14(17)10-8-9-13(16)15-12(5-2)6-3/h12H,4-11H2,1-3H3,(H,15,16)
InChIKey RMHYACMHJPHUDN-UHFFFAOYSA-N
Molecular Weight 257.374 g/mol
SMILES CCC(NC(CCCC(OCCCC)=O)=O)CC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.906853