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14-Methyl-pentadecanoic acid, dmox derivative

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14-Methyl-pentadecanoic acid, dmox derivative
SpectraBase Compound ID 44tUki1t95V
InChI InChI=1S/C20H39NO/c1-18(2)15-13-11-9-7-5-6-8-10-12-14-16-19-21-20(3,4)17-22-19/h18H,5-17H2,1-4H3
InChIKey FQAGQNGJVQRVPA-UHFFFAOYSA-N
Mol Weight 309.5 g/mol
Molecular Formula C20H39NO
Exact Mass 309.303165 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CQIbeSAe0oM
Name 14-Methyl-pentadecanoic acid, dmox derivative
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 309.303164879 u
Formula C20H39NO
InChI InChI=1S/C20H39NO/c1-18(2)15-13-11-9-7-5-6-8-10-12-14-16-19-21-20(3,4)17-22-19/h18H,5-17H2,1-4H3
InChIKey FQAGQNGJVQRVPA-UHFFFAOYSA-N
Molecular Weight 309.538 g/mol
SMILES C1(=NC(C)(C)CO1)CCCCCCCCCCCCC(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.866244