8,11,14,17-Octadecatetraenoic acid, dmox derivative

SpectraBase Compound ID	5gvWEILELn3
InChI	InChI=1S/C22H35NO/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/h4,6-7,9-10,12-13H,1,5,8,11,14-20H2,2-3H3/b7-6-,10-9-,13-12-
InChIKey	WZQODPIUMMRLJO-QNEBEIHSSA-N Google Search
Mol Weight	329.5 g/mol
Molecular Formula	C22H35NO
Exact Mass	329.271865 g/mol

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SpectraBase Spectrum ID	7DQUehiOFPp
Name	8,11,14,17-Octadecatetraenoic acid, dmox derivative
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	329.271864750 u
Formula	C22H35NO
InChI	InChI=1S/C22H35NO/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/h4,6-7,9-10,12-13H,1,5,8,11,14-20H2,2-3H3/b7-6-,10-9-,13-12-
InChIKey	WZQODPIUMMRLJO-QNEBEIHSSA-N
Molecular Weight	329.528 g/mol
SMILES	C=1(CCCCCC\C=C/C\C=C/C\C=C/CC=C)OCC(N1)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR)	0.942501