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Oxalic acid, monomorpholide, isohexyl ester

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Oxalic acid, monomorpholide, isohexyl ester
SpectraBase Compound ID LCfPlBc1uET
InChI InChI=1S/C12H21NO4/c1-10(2)4-3-7-17-12(15)11(14)13-5-8-16-9-6-13/h10H,3-9H2,1-2H3
InChIKey UPOAALVWPZZRMS-UHFFFAOYSA-N
Mol Weight 243.3 g/mol
Molecular Formula C12H21NO4
Exact Mass 243.147058 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6i61hjvRgj0
Name Oxalic acid, monomorpholide, isohexyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 243.147058156 u
Formula C12H21NO4
InChI InChI=1S/C12H21NO4/c1-10(2)4-3-7-17-12(15)11(14)13-5-8-16-9-6-13/h10H,3-9H2,1-2H3
InChIKey UPOAALVWPZZRMS-UHFFFAOYSA-N
Molecular Weight 243.303 g/mol
SMILES CC(C)CCCOC(C(=O)N1CCOCC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.905003