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L-Allylglycine, N-ethoxycarbonyl-, ethyl ester

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

L-Allylglycine, N-ethoxycarbonyl-, ethyl ester
SpectraBase Compound ID Csagu3WOdw8
InChI InChI=1S/C10H17NO4/c1-4-7-8(9(12)14-5-2)11-10(13)15-6-3/h4,8H,1,5-7H2,2-3H3,(H,11,13)
InChIKey LHZAMTUXASTZKJ-UHFFFAOYSA-N
Mol Weight 215.25 g/mol
Molecular Formula C10H17NO4
Exact Mass 215.115758 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LSB9hDhgdtu
Name L-Allylglycine, N-ethoxycarbonyl-, ethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 215.115758027 u
Formula C10H17NO4
InChI InChI=1S/C10H17NO4/c1-4-7-8(9(12)14-5-2)11-10(13)15-6-3/h4,8H,1,5-7H2,2-3H3,(H,11,13)
InChIKey LHZAMTUXASTZKJ-UHFFFAOYSA-N
Molecular Weight 215.249 g/mol
SMILES CCOC(NC(C(OCC)=O)CC=C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.930928