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17-Octadecenoic acid, dmox derivative

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17-Octadecenoic acid, dmox derivative
SpectraBase Compound ID 5tOZbJAKKe8
InChI InChI=1S/C22H41NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-23-22(2,3)20-24-21/h4H,1,5-20H2,2-3H3
InChIKey LBELYUWQKKGEHA-UHFFFAOYSA-N
Mol Weight 335.6 g/mol
Molecular Formula C22H41NO
Exact Mass 335.318815 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7568ET5flbh
Name 17-Octadecenoic acid, dmox derivative
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.318814943 u
Formula C22H41NO
InChI InChI=1S/C22H41NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-23-22(2,3)20-24-21/h4H,1,5-20H2,2-3H3
InChIKey LBELYUWQKKGEHA-UHFFFAOYSA-N
Molecular Weight 335.576 g/mol
SMILES C=1(CCCCCCCCCCCCCCCC=C)OCC(N1)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.813976