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Glycine, N-methyl-N-propoxycarbonyl-, isohexyl ester

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Glycine, N-methyl-N-propoxycarbonyl-, isohexyl ester
SpectraBase Compound ID 92psQGxbtnU
InChI InChI=1S/C13H25NO4/c1-5-8-18-13(16)14(4)10-12(15)17-9-6-7-11(2)3/h11H,5-10H2,1-4H3
InChIKey OROPMVJNLFNQTJ-UHFFFAOYSA-N
Mol Weight 259.35 g/mol
Molecular Formula C13H25NO4
Exact Mass 259.178358 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IUoz6HcKyYl
Name Glycine, N-methyl-N-propoxycarbonyl-, isohexyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 259.178358285 u
Formula C13H25NO4
InChI InChI=1S/C13H25NO4/c1-5-8-18-13(16)14(4)10-12(15)17-9-6-7-11(2)3/h11H,5-10H2,1-4H3
InChIKey OROPMVJNLFNQTJ-UHFFFAOYSA-N
Molecular Weight 259.346 g/mol
SMILES CCCOC(N(CC(OCCCC(C)C)=O)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.900296