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4(1H)-Pyridinone, 3-methoxy-2-methyl-6-(11-oxododecyl)-

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

4(1H)-Pyridinone, 3-methoxy-2-methyl-6-(11-oxododecyl)-
SpectraBase Compound ID IKiPhiKCkC7
InChI InChI=1S/C19H31NO3/c1-15(21)12-10-8-6-4-5-7-9-11-13-17-14-18(22)19(23-3)16(2)20-17/h14H,4-13H2,1-3H3,(H,20,22)
InChIKey MBHUVYWCZVGFQU-UHFFFAOYSA-N
Mol Weight 321.46 g/mol
Molecular Formula C19H31NO3
Exact Mass 321.230394 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID J74c2LFKdTE
Name 4(1H)-Pyridinone, 3-methoxy-2-methyl-6-(11-oxododecyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 321.230393859 u
Formula C19H31NO3
InChI InChI=1S/C19H31NO3/c1-15(21)12-10-8-6-4-5-7-9-11-13-17-14-18(22)19(23-3)16(2)20-17/h14H,4-13H2,1-3H3,(H,20,22)
InChIKey MBHUVYWCZVGFQU-UHFFFAOYSA-N
Molecular Weight 321.461 g/mol
SMILES C1(=C(NC(=CC1=O)CCCCCCCCCCC(=O)C)C)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.885894