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Oxalic acid, monoamide, N,N-bis(2-ethylhexyl)-, heptyl ester

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Oxalic acid, monoamide, N,N-bis(2-ethylhexyl)-, heptyl ester
SpectraBase Compound ID IJIu6M20u9t
InChI InChI=1S/C25H49NO3/c1-6-11-14-15-16-19-29-25(28)24(27)26(20-22(9-4)17-12-7-2)21-23(10-5)18-13-8-3/h22-23H,6-21H2,1-5H3
InChIKey KQNQRRSUNQZYRL-UHFFFAOYSA-N
Mol Weight 411.7 g/mol
Molecular Formula C25H49NO3
Exact Mass 411.371244 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ey8ampOBlQp
Name Oxalic acid, monoamide, N,N-bis(2-ethylhexyl)-, heptyl ester
Comments Computed using HOSE algorithm
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Exact Mass 411.371244439 u
Formula C25H49NO3
InChI InChI=1S/C25H49NO3/c1-6-11-14-15-16-19-29-25(28)24(27)26(20-22(9-4)17-12-7-2)21-23(10-5)18-13-8-3/h22-23H,6-21H2,1-5H3
InChIKey KQNQRRSUNQZYRL-UHFFFAOYSA-N
Molecular Weight 411.671 g/mol
SMILES C(C(=O)OCCCCCCC)(N(CC(CC)CCCC)CC(CCCC)CC)=O