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Oxalic acid, monoamide, N-(2-octyl)-, pentyl ester

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Oxalic acid, monoamide, N-(2-octyl)-, pentyl ester
SpectraBase Compound ID 3OgYnN542NQ
InChI InChI=1S/C15H29NO3/c1-4-6-8-9-11-13(3)16-14(17)15(18)19-12-10-7-5-2/h13H,4-12H2,1-3H3,(H,16,17)
InChIKey HFSATPKPNZEIRV-UHFFFAOYSA-N
Mol Weight 271.4 g/mol
Molecular Formula C15H29NO3
Exact Mass 271.214744 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DHH3zQ7zdZ6
Name Oxalic acid, monoamide, N-(2-octyl)-, pentyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 271.214743795 u
Formula C15H29NO3
InChI InChI=1S/C15H29NO3/c1-4-6-8-9-11-13(3)16-14(17)15(18)19-12-10-7-5-2/h13H,4-12H2,1-3H3,(H,16,17)
InChIKey HFSATPKPNZEIRV-UHFFFAOYSA-N
Molecular Weight 271.401 g/mol
SMILES CCCCCOC(C(=O)NC(CCCCCC)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.981038