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1,3,5-Pentanetricarboxamide, N,N',N''-triheptyl-N,N',N''-trimethyl-
SpectraBase Compound ID a8WlsEjBvX
InChI InChI=1S/C32H63N3O3/c1-7-10-13-16-19-26-33(4)30(36)24-22-29(32(38)35(6)28-21-18-15-12-9-3)23-25-31(37)34(5)27-20-17-14-11-8-2/h29H,7-28H2,1-6H3
InChIKey IOKYHUBRCIQHGF-UHFFFAOYSA-N
Mol Weight 537.9 g/mol
Molecular Formula C32H63N3O3
Exact Mass 537.486943 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LenJmynAxkw
Name 1,3,5-Pentanetricarboxamide, N,N',N''-triheptyl-N,N',N''-trimethyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 537.486942898 u
Formula C32H63N3O3
InChI InChI=1S/C32H63N3O3/c1-7-10-13-16-19-26-33(4)30(36)24-22-29(32(38)35(6)28-21-18-15-12-9-3)23-25-31(37)34(5)27-20-17-14-11-8-2/h29H,7-28H2,1-6H3
InChIKey IOKYHUBRCIQHGF-UHFFFAOYSA-N
Molecular Weight 537.874 g/mol
SMILES CN(C(=O)CCC(CCC(N(C)CCCCCCC)=O)C(N(C)CCCCCCC)=O)CCCCCCC