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Oxalic acid, monoamide, N-(2-fluorophenyl)-, isobutyl ester

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Oxalic acid, monoamide, N-(2-fluorophenyl)-, isobutyl ester
SpectraBase Compound ID 4UA8JRdihXF
InChI InChI=1S/C12H14FNO3/c1-8(2)7-17-12(16)11(15)14-10-6-4-3-5-9(10)13/h3-6,8H,7H2,1-2H3,(H,14,15)
InChIKey RXYVUHLRNFGXDP-UHFFFAOYSA-N
Mol Weight 239.25 g/mol
Molecular Formula C12H14FNO3
Exact Mass 239.095771 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1tFpsRJooVt
Name Oxalic acid, monoamide, N-(2-fluorophenyl)-, isobutyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 239.095771475 u
Formula C12H14FNO3
InChI InChI=1S/C12H14FNO3/c1-8(2)7-17-12(16)11(15)14-10-6-4-3-5-9(10)13/h3-6,8H,7H2,1-2H3,(H,14,15)
InChIKey RXYVUHLRNFGXDP-UHFFFAOYSA-N
Molecular Weight 239.246 g/mol
SMILES C(C(=O)NC1=CC=CC=C1F)(OCC(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.961532