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Benzamide, 4-nitro-N-benzyl-N-dodecyl-
SpectraBase Compound ID DCvNxc6BhsQ
InChI InChI=1S/C26H36N2O3/c1-2-3-4-5-6-7-8-9-10-14-21-27(22-23-15-12-11-13-16-23)26(29)24-17-19-25(20-18-24)28(30)31/h11-13,15-20H,2-10,14,21-22H2,1H3
InChIKey HKUIIHWOPUXYKM-UHFFFAOYSA-N
Mol Weight 424.6 g/mol
Molecular Formula C26H36N2O3
Exact Mass 424.272593 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GH5feBZjanE
Name Benzamide, 4-nitro-N-benzyl-N-dodecyl-
Comments Computed using HOSE algorithm
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Exact Mass 424.272593024 u
Formula C26H36N2O3
InChI InChI=1S/C26H36N2O3/c1-2-3-4-5-6-7-8-9-10-14-21-27(22-23-15-12-11-13-16-23)26(29)24-17-19-25(20-18-24)28(30)31/h11-13,15-20H,2-10,14,21-22H2,1H3
InChIKey HKUIIHWOPUXYKM-UHFFFAOYSA-N
Molecular Weight 424.585 g/mol
SMILES C(N(CCCCCCCCCCCC)CC1=CC=CC=C1)(=O)C=1C=CC(=CC1)N(=O)=O