1,3,5-Triazine, 2,4,6-tris[(2-pentylnonyl)oxy]-

SpectraBase Compound ID	JmYsMIkoMXl
InChI	InChI=1S/C45H87N3O3/c1-7-13-19-22-28-34-40(31-25-16-10-4)37-49-43-46-44(50-38-41(32-26-17-11-5)35-29-23-20-14-8-2)48-45(47-43)51-39-42(33-27-18-12-6)36-30-24-21-15-9-3/h40-42H,7-39H2,1-6H3
InChIKey	ITAWNHPLUNHZDD-UHFFFAOYSA-N Google Search
Mol Weight	718.2 g/mol
Molecular Formula	C45H87N3O3
Exact Mass	717.674744 g/mol

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SpectraBase Spectrum ID	6vm6F8U8mCL
Name	1,3,5-Triazine, 2,4,6-tris[(2-pentylnonyl)oxy]-
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	717.674743670 u
Formula	C45H87N3O3
InChI	InChI=1S/C45H87N3O3/c1-7-13-19-22-28-34-40(31-25-16-10-4)37-49-43-46-44(50-38-41(32-26-17-11-5)35-29-23-20-14-8-2)48-45(47-43)51-39-42(33-27-18-12-6)36-30-24-21-15-9-3/h40-42H,7-39H2,1-6H3
InChIKey	ITAWNHPLUNHZDD-UHFFFAOYSA-N
Molecular Weight	718.209 g/mol
SMILES	C=1(N=C(N=C(N1)OCC(CCCCC)CCCCCCC)OCC(CCCCC)CCCCCCC)OCC(CCCCCCC)CCCCC