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Glycine, N-(2-chloroethoxycarbonyl)-, propyl ester

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

Glycine, N-(2-chloroethoxycarbonyl)-, propyl ester
SpectraBase Compound ID ChI5ny1WNjs
InChI InChI=1S/C8H14ClNO4/c1-2-4-13-7(11)6-10-8(12)14-5-3-9/h2-6H2,1H3,(H,10,12)
InChIKey XEEQDSFFFUUOOF-UHFFFAOYSA-N
Mol Weight 223.66 g/mol
Molecular Formula C8H14ClNO4
Exact Mass 223.061136 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KaVcnurwfgc
Name Glycine, N-(2-chloroethoxycarbonyl)-, propyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 223.061135631 u
Formula C8H14ClNO4
InChI InChI=1S/C8H14ClNO4/c1-2-4-13-7(11)6-10-8(12)14-5-3-9/h2-6H2,1H3,(H,10,12)
InChIKey XEEQDSFFFUUOOF-UHFFFAOYSA-N
Molecular Weight 223.656 g/mol
SMILES CCCOC(CNC(OCCCl)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.968609