7,10-Octadecadienoic acid, dmox derivative

SpectraBase Compound ID	12bN07WDK3U
InChI	InChI=1S/C22H39NO/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/h10-11,13-14H,4-9,12,15-20H2,1-3H3/b11-10-,14-13-
InChIKey	DOXBECWNTLYFGP-XVTLYKPTSA-N Google Search
Mol Weight	333.6 g/mol
Molecular Formula	C22H39NO
Exact Mass	333.303165 g/mol

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SpectraBase Spectrum ID	BbIgZ5dMoer
Name	7,10-Octadecadienoic acid, dmox derivative
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	333.303164879 u
Formula	C22H39NO
InChI	InChI=1S/C22H39NO/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/h10-11,13-14H,4-9,12,15-20H2,1-3H3/b11-10-,14-13-
InChIKey	DOXBECWNTLYFGP-XVTLYKPTSA-N
Molecular Weight	333.560 g/mol
SMILES	C=1(CCCCC\C=C/C\C=C/CCCCCCC)OCC(N1)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR)	0.967829