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N-Methoxycarbonyl-N-(4-methoxycarbonyloxyphenyl)glycine, methyl ester
SpectraBase Compound ID CymB7i59gr3
InChI InChI=1S/C13H15NO7/c1-18-11(15)8-14(12(16)19-2)9-4-6-10(7-5-9)21-13(17)20-3/h4-7H,8H2,1-3H3
InChIKey ZXGMOUSNNIOCFY-UHFFFAOYSA-N
Mol Weight 297.26 g/mol
Molecular Formula C13H15NO7
Exact Mass 297.084852 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7ED6MEwPTL7
Name N-Methoxycarbonyl-N-(4-methoxycarbonyloxyphenyl)glycine, methyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 297.084851820 u
Formula C13H15NO7
InChI InChI=1S/C13H15NO7/c1-18-11(15)8-14(12(16)19-2)9-4-6-10(7-5-9)21-13(17)20-3/h4-7H,8H2,1-3H3
InChIKey ZXGMOUSNNIOCFY-UHFFFAOYSA-N
Molecular Weight 297.263 g/mol
SMILES C1=CC(=CC=C1N(CC(OC)=O)C(OC)=O)OC(OC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.968376