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Acetic acid, 2-[5-(2-methoxyphenyl)-2-oxo-3-tetrahydrofuroylamino]-, ethyl ester
SpectraBase Compound ID ApLjTURBSZq
InChI InChI=1S/C16H19NO6/c1-3-22-14(18)9-17-15(19)11-8-13(23-16(11)20)10-6-4-5-7-12(10)21-2/h4-7,11,13H,3,8-9H2,1-2H3,(H,17,19)
InChIKey YTIZMPJLKUCVTQ-UHFFFAOYSA-N
Mol Weight 321.33 g/mol
Molecular Formula C16H19NO6
Exact Mass 321.121237 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BwGYIeKuzit
Name Acetic acid, 2-[5-(2-methoxyphenyl)-2-oxo-3-tetrahydrofuroylamino]-, ethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 321.121237330 u
Formula C16H19NO6
InChI InChI=1S/C16H19NO6/c1-3-22-14(18)9-17-15(19)11-8-13(23-16(11)20)10-6-4-5-7-12(10)21-2/h4-7,11,13H,3,8-9H2,1-2H3,(H,17,19)
InChIKey YTIZMPJLKUCVTQ-UHFFFAOYSA-N
Molecular Weight 321.329 g/mol
SMILES C1(C(OC(C1)C1=CC=CC=C1OC)=O)C(NCC(OCC)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.86459