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Ethyl (4-((3-((ethoxycarbonyl)amino)propyl)amino)butyl)carbamate

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

Ethyl (4-((3-((ethoxycarbonyl)amino)propyl)amino)butyl)carbamate
SpectraBase Compound ID ELrRIVEg5gV
InChI InChI=1S/C13H27N3O4/c1-3-19-12(17)15-10-6-5-8-14-9-7-11-16-13(18)20-4-2/h14H,3-11H2,1-2H3,(H,15,17)(H,16,18)
InChIKey UJGQXAVWXYNFNT-UHFFFAOYSA-N
Mol Weight 289.38 g/mol
Molecular Formula C13H27N3O4
Exact Mass 289.200156 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8pcc2XRLQ4t
Name Ethyl (4-((3-((ethoxycarbonyl)amino)propyl)amino)butyl)carbamate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 289.200156357 u
Formula C13H27N3O4
InChI InChI=1S/C13H27N3O4/c1-3-19-12(17)15-10-6-5-8-14-9-7-11-16-13(18)20-4-2/h14H,3-11H2,1-2H3,(H,15,17)(H,16,18)
InChIKey UJGQXAVWXYNFNT-UHFFFAOYSA-N
Molecular Weight 289.376 g/mol
SMILES CCOC(NCCCCNCCCNC(OCC)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.917999