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.alpha.-Methyl-dl-phenylalanine, N-(ethoxycarbonyl)-, methyl ester

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

.alpha.-Methyl-dl-phenylalanine, N-(ethoxycarbonyl)-, methyl ester
SpectraBase Compound ID 9959idJV0kW
InChI InChI=1S/C14H19NO4/c1-4-19-13(17)15-14(2,12(16)18-3)10-11-8-6-5-7-9-11/h5-9H,4,10H2,1-3H3,(H,15,17)
InChIKey RSTPHKGOQNJBLB-UHFFFAOYSA-N
Mol Weight 265.31 g/mol
Molecular Formula C14H19NO4
Exact Mass 265.131408 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9XDrW3D1XAn
Name .alpha.-Methyl-dl-phenylalanine, N-(ethoxycarbonyl)-, methyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 265.131408092 u
Formula C14H19NO4
InChI InChI=1S/C14H19NO4/c1-4-19-13(17)15-14(2,12(16)18-3)10-11-8-6-5-7-9-11/h5-9H,4,10H2,1-3H3,(H,15,17)
InChIKey RSTPHKGOQNJBLB-UHFFFAOYSA-N
Molecular Weight 265.309 g/mol
SMILES C1(=CC=CC=C1)CC(C)(NC(OCC)=O)C(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.96574