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Methyl N-(phenylglyoxyl)valinate
SpectraBase Compound ID IuyOP5htlDA
InChI InChI=1S/C14H17NO4/c1-9(2)11(14(18)19-3)15-13(17)12(16)10-7-5-4-6-8-10/h4-9,11H,1-3H3,(H,15,17)
InChIKey LIEGURDVQMKRKT-UHFFFAOYSA-N
Mol Weight 263.29 g/mol
Molecular Formula C14H17NO4
Exact Mass 263.115758 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GOcVbLOnyCH
Name Methyl N-(phenylglyoxyl)valinate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 263.115758027 u
Formula C14H17NO4
InChI InChI=1S/C14H17NO4/c1-9(2)11(14(18)19-3)15-13(17)12(16)10-7-5-4-6-8-10/h4-9,11H,1-3H3,(H,15,17)
InChIKey LIEGURDVQMKRKT-UHFFFAOYSA-N
Molecular Weight 263.293 g/mol
SMILES C(NC(C(=O)OC)C(C)C)(C(=O)C=1C=CC=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.981164