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Glycine, N-(2-methoxyethoxycarbonyl)-, isohexyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Glycine, N-(2-methoxyethoxycarbonyl)-, isohexyl ester
SpectraBase Compound ID CxHETMaWG5p
InChI InChI=1S/C12H23NO5/c1-10(2)5-4-6-17-11(14)9-13-12(15)18-8-7-16-3/h10H,4-9H2,1-3H3,(H,13,15)
InChIKey NQBSWJNBFQULEN-UHFFFAOYSA-N
Mol Weight 261.32 g/mol
Molecular Formula C12H23NO5
Exact Mass 261.157623 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID kLwwN3mPsC
Name Glycine, N-(2-methoxyethoxycarbonyl)-, isohexyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 261.157622840 u
Formula C12H23NO5
InChI InChI=1S/C12H23NO5/c1-10(2)5-4-6-17-11(14)9-13-12(15)18-8-7-16-3/h10H,4-9H2,1-3H3,(H,13,15)
InChIKey NQBSWJNBFQULEN-UHFFFAOYSA-N
Molecular Weight 261.318 g/mol
SMILES COCCOC(NCC(OCCCC(C)C)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.912042