For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

gly-ala, N-Methoxycarbonyl-, methyl ester

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

gly-ala, N-Methoxycarbonyl-, methyl ester
SpectraBase Compound ID 4sM7QBUqdjJ
InChI InChI=1S/C8H14N2O5/c1-5(7(12)14-2)10-6(11)4-9-8(13)15-3/h5H,4H2,1-3H3,(H,9,13)(H,10,11)
InChIKey CMDBLCHYNKEYKQ-UHFFFAOYSA-N
Mol Weight 218.21 g/mol
Molecular Formula C8H14N2O5
Exact Mass 218.090272 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 81FYyx4Eaxz
Name gly-ala, N-Methoxycarbonyl-, methyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 218.090271554 u
Formula C8H14N2O5
InChI InChI=1S/C8H14N2O5/c1-5(7(12)14-2)10-6(11)4-9-8(13)15-3/h5H,4H2,1-3H3,(H,9,13)(H,10,11)
InChIKey CMDBLCHYNKEYKQ-UHFFFAOYSA-N
Molecular Weight 218.209 g/mol
SMILES C(NC(CNC(OC)=O)=O)(C(OC)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.953379