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N-Carbobenzyloxy-serylglycine methyl ester

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

N-Carbobenzyloxy-serylglycine methyl ester
SpectraBase Compound ID 3r9fUO8lPjP
InChI InChI=1S/C14H18N2O6/c1-21-12(18)7-15-13(19)11(8-17)16-14(20)22-9-10-5-3-2-4-6-10/h2-6,11,17H,7-9H2,1H3,(H,15,19)(H,16,20)
InChIKey XTWNJYQZGKQPMP-UHFFFAOYSA-N
Mol Weight 310.31 g/mol
Molecular Formula C14H18N2O6
Exact Mass 310.116486 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7swQ5FiAhYa
Name N-Carbobenzyloxy-serylglycine methyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 310.116486302 u
Formula C14H18N2O6
InChI InChI=1S/C14H18N2O6/c1-21-12(18)7-15-13(19)11(8-17)16-14(20)22-9-10-5-3-2-4-6-10/h2-6,11,17H,7-9H2,1H3,(H,15,19)(H,16,20)
InChIKey XTWNJYQZGKQPMP-UHFFFAOYSA-N
Molecular Weight 310.306 g/mol
SMILES C1(=CC=CC=C1)COC(NC(CO)C(NCC(OC)=O)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.860598