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Oxalic acid, monoamide, N-propyl, heptyl ester

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Oxalic acid, monoamide, N-propyl, heptyl ester
SpectraBase Compound ID DDxxJbgax2i
InChI InChI=1S/C12H23NO3/c1-3-5-6-7-8-10-16-12(15)11(14)13-9-4-2/h3-10H2,1-2H3,(H,13,14)
InChIKey NMAPZKFDOVZRKM-UHFFFAOYSA-N
Mol Weight 229.32 g/mol
Molecular Formula C12H23NO3
Exact Mass 229.167794 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Hc0OGylkATB
Name Oxalic acid, monoamide, N-propyl, heptyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 229.167793602 u
Formula C12H23NO3
InChI InChI=1S/C12H23NO3/c1-3-5-6-7-8-10-16-12(15)11(14)13-9-4-2/h3-10H2,1-2H3,(H,13,14)
InChIKey NMAPZKFDOVZRKM-UHFFFAOYSA-N
Molecular Weight 229.320 g/mol
SMILES CCCCCCCOC(C(NCCC)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.873219