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N,N',N"-Trioctyl-1,3,5-benzene-tricarboxamide
SpectraBase Compound ID JW5y4hSeo4u
InChI InChI=1S/C33H57N3O3/c1-4-7-10-13-16-19-22-34-31(37)28-25-29(32(38)35-23-20-17-14-11-8-5-2)27-30(26-28)33(39)36-24-21-18-15-12-9-6-3/h25-27H,4-24H2,1-3H3,(H,34,37)(H,35,38)(H,36,39)
InChIKey HVHZKCRRIADHDW-UHFFFAOYSA-N
Mol Weight 543.8 g/mol
Molecular Formula C33H57N3O3
Exact Mass 543.439993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JETnGoJVqTR
Name N,N',N"-Trioctyl-1,3,5-benzene-tricarboxamide
Alternate Name(s) N(1),N(3),N(5)-trioctyl-1,3,5-benzenetricarboxamide 1-N,3-N,5-N-trioctylbenzene-1,3,5-tricarboxamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H57N3O3
InChI InChI=1S/C33H57N3O3/c1-4-7-10-13-16-19-22-34-31(37)28-25-29(32(38)35-23-20-17-14-11-8-5-2)27-30(26-28)33(39)36-24-21-18-15-12-9-6-3/h25-27H,4-24H2,1-3H3,(H,34,37)(H,35,38)(H,36,39)
InChIKey HVHZKCRRIADHDW-UHFFFAOYSA-N
Molecular Weight 543.837 g/mol
SMILES N(C(c1cc(C(=O)NCCCCCCCC)cc(c1)C(=O)NCCCCCCCC)=O)CCCCCCCC
SPLASH splash10-014l-0000960000-bee2cdf2bdcda0f833a7
Source of Spectrum D8-329-158-0
Wiley ID 1516171