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Oxalic acid, monoamide, N-(4-methoxybenzyl)-, pentyl ester

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Oxalic acid, monoamide, N-(4-methoxybenzyl)-, pentyl ester
SpectraBase Compound ID H1Dv7SapQc7
InChI InChI=1S/C15H21NO4/c1-3-4-5-10-20-15(18)14(17)16-11-12-6-8-13(19-2)9-7-12/h6-9H,3-5,10-11H2,1-2H3,(H,16,17)
InChIKey QHLJYQDVDQCSRC-UHFFFAOYSA-N
Mol Weight 279.34 g/mol
Molecular Formula C15H21NO4
Exact Mass 279.147058 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID H2lj0gLS31Z
Name Oxalic acid, monoamide, N-(4-methoxybenzyl)-, pentyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 279.147058156 u
Formula C15H21NO4
InChI InChI=1S/C15H21NO4/c1-3-4-5-10-20-15(18)14(17)16-11-12-6-8-13(19-2)9-7-12/h6-9H,3-5,10-11H2,1-2H3,(H,16,17)
InChIKey QHLJYQDVDQCSRC-UHFFFAOYSA-N
Molecular Weight 279.336 g/mol
SMILES CCCCCOC(C(=O)NCC1=CC=C(OC)C=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.969244