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Carbonic acid, monoamide, N-propyl-N-(3-methylbutyl)-, butyl ester

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Carbonic acid, monoamide, N-propyl-N-(3-methylbutyl)-, butyl ester
SpectraBase Compound ID 7owkBeu0MnZ
InChI InChI=1S/C13H27NO2/c1-5-7-11-16-13(15)14(9-6-2)10-8-12(3)4/h12H,5-11H2,1-4H3
InChIKey GFDOAKKVLLLPDJ-UHFFFAOYSA-N
Mol Weight 229.36 g/mol
Molecular Formula C13H27NO2
Exact Mass 229.204179 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3e2f0utPRMr
Name Carbonic acid, monoamide, N-propyl-N-(3-methylbutyl)-, butyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 229.204179111 u
Formula C13H27NO2
InChI InChI=1S/C13H27NO2/c1-5-7-11-16-13(15)14(9-6-2)10-8-12(3)4/h12H,5-11H2,1-4H3
InChIKey GFDOAKKVLLLPDJ-UHFFFAOYSA-N
Molecular Weight 229.364 g/mol
SMILES C(N(CCC)CCC(C)C)(=O)OCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.944928