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14-Methyl-heptadecanoic acid, dmox derivative

View entire compound with spectra: 1 NMR, and 1 FTIR

14-Methyl-heptadecanoic acid, dmox derivative
SpectraBase Compound ID 2GCKOGhCcq3
InChI InChI=1S/C22H43NO/c1-5-16-20(2)17-14-12-10-8-6-7-9-11-13-15-18-21-23-22(3,4)19-24-21/h20H,5-19H2,1-4H3
InChIKey GFJIQPUZRJSBJO-UHFFFAOYSA-N
Mol Weight 337.6 g/mol
Molecular Formula C22H43NO
Exact Mass 337.334465 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7wy3etkCB0D
Name 14-Methyl-heptadecanoic acid, dmox derivative
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 337.334465008 u
Formula C22H43NO
InChI InChI=1S/C22H43NO/c1-5-16-20(2)17-14-12-10-8-6-7-9-11-13-15-18-21-23-22(3,4)19-24-21/h20H,5-19H2,1-4H3
InChIKey GFJIQPUZRJSBJO-UHFFFAOYSA-N
Molecular Weight 337.592 g/mol
SMILES C=1(CCCCCCCCCCCCC(CCC)C)OCC(N1)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.88045