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Benzamide, 4-nitro-N-(4-nitrobenzoyl)-N-hexyl-

View entire compound with spectra: 1 NMR

Benzamide, 4-nitro-N-(4-nitrobenzoyl)-N-hexyl-
SpectraBase Compound ID Bb6qvzaw3T8
InChI InChI=1S/C20H21N3O6/c1-2-3-4-5-14-21(19(24)15-6-10-17(11-7-15)22(26)27)20(25)16-8-12-18(13-9-16)23(28)29/h6-13H,2-5,14H2,1H3
InChIKey MIJWUEOFKNJPCH-UHFFFAOYSA-N
Mol Weight 399.4 g/mol
Molecular Formula C20H21N3O6
Exact Mass 399.143035 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8vkpUR1DqDp
Name Benzamide, 4-nitro-N-(4-nitrobenzoyl)-N-hexyl-
Comments Computed using HOSE algorithm
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Exact Mass 399.143035402 u
Formula C20H21N3O6
InChI InChI=1S/C20H21N3O6/c1-2-3-4-5-14-21(19(24)15-6-10-17(11-7-15)22(26)27)20(25)16-8-12-18(13-9-16)23(28)29/h6-13H,2-5,14H2,1H3
InChIKey MIJWUEOFKNJPCH-UHFFFAOYSA-N
Molecular Weight 399.403 g/mol
SMILES C1=C(C=CC(=C1)N(=O)=O)C(N(CCCCCC)C(=O)C1=CC=C(C=C1)N(=O)=O)=O