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D-Allylglycine, N-(2-methoxyethylcarbonyl)-, butyl ester

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D-Allylglycine, N-(2-methoxyethylcarbonyl)-, butyl ester
SpectraBase Compound ID EmdBpN3RiOo
InChI InChI=1S/C13H23NO5/c1-4-6-8-18-12(15)11(7-5-2)14-13(16)19-10-9-17-3/h5,11H,2,4,6-10H2,1,3H3,(H,14,16)
InChIKey UKVFRKNEERBASL-UHFFFAOYSA-N
Mol Weight 273.33 g/mol
Molecular Formula C13H23NO5
Exact Mass 273.157623 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GaKzoEcB5ac
Name D-Allylglycine, N-(2-methoxyethylcarbonyl)-, butyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 273.157622840 u
Formula C13H23NO5
InChI InChI=1S/C13H23NO5/c1-4-6-8-18-12(15)11(7-5-2)14-13(16)19-10-9-17-3/h5,11H,2,4,6-10H2,1,3H3,(H,14,16)
InChIKey UKVFRKNEERBASL-UHFFFAOYSA-N
Molecular Weight 273.329 g/mol
SMILES C(COC(C(NC(=O)OCCOC)CC=C)=O)CC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.821525