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Glycine, N-methyl-N-propoxycarbonyl-, hexyl ester

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Glycine, N-methyl-N-propoxycarbonyl-, hexyl ester
SpectraBase Compound ID 6cmtBxdS3TY
InChI InChI=1S/C13H25NO4/c1-4-6-7-8-10-17-12(15)11-14(3)13(16)18-9-5-2/h4-11H2,1-3H3
InChIKey ABITVDVGJFPEQZ-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 HjNZld9xHB6
Name Glycine, N-methyl-N-propoxycarbonyl-, hexyl 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/c1-4-6-7-8-10-17-12(15)11-14(3)13(16)18-9-5-2/h4-11H2,1-3H3
InChIKey ABITVDVGJFPEQZ-UHFFFAOYSA-N
Molecular Weight 259.346 g/mol
SMILES CCCOC(N(CC(OCCCCCC)=O)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.828343