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N,N',N"-Trihexyl-1,3,5-benzene-tricarboxamide
SpectraBase Compound ID IXd2789Dlv0
InChI InChI=1S/C27H45N3O3/c1-4-7-10-13-16-28-25(31)22-19-23(26(32)29-17-14-11-8-5-2)21-24(20-22)27(33)30-18-15-12-9-6-3/h19-21H,4-18H2,1-3H3,(H,28,31)(H,29,32)(H,30,33)
InChIKey ZNNCKUXSMKJGJG-UHFFFAOYSA-N
Mol Weight 459.7 g/mol
Molecular Formula C27H45N3O3
Exact Mass 459.346092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LdSsNmhmPMM
Name N,N',N"-Trihexyl-1,3,5-benzene-tricarboxamide
Alternate Name(s) N(1),N(3),N(5)-trihexyl-1,3,5-benzenetricarboxamide 1-N,3-N,5-N-trihexylbenzene-1,3,5-tricarboxamide
Comments Less than 3 mono-isotopic peaks
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Formula C27H45N3O3
InChI InChI=1S/C27H45N3O3/c1-4-7-10-13-16-28-25(31)22-19-23(26(32)29-17-14-11-8-5-2)21-24(20-22)27(33)30-18-15-12-9-6-3/h19-21H,4-18H2,1-3H3,(H,28,31)(H,29,32)(H,30,33)
InChIKey ZNNCKUXSMKJGJG-UHFFFAOYSA-N
Molecular Weight 459.675 g/mol
SMILES N(C(c1cc(C(=O)NCCCCCC)cc(c1)C(=O)NCCCCCC)=O)CCCCCC
SPLASH splash10-0a4i-0009300000-e2272e7eb1592e202e26
Source of Spectrum D8-329-158-0
Wiley ID 1516173