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Benzamide, 4-nitro-N-(2-pentyl)-N-(2-ethylhexyl)-
SpectraBase Compound ID DxlsYEw5n9v
InChI InChI=1S/C20H32N2O3/c1-5-8-10-17(7-3)15-21(16(4)9-6-2)20(23)18-11-13-19(14-12-18)22(24)25/h11-14,16-17H,5-10,15H2,1-4H3
InChIKey ITSKKUHDLJRSLQ-UHFFFAOYSA-N
Mol Weight 348.5 g/mol
Molecular Formula C20H32N2O3
Exact Mass 348.241293 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L8XVJe2SvTz
Name Benzamide, 4-nitro-N-(2-pentyl)-N-(2-ethylhexyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 348.241292895 u
Formula C20H32N2O3
InChI InChI=1S/C20H32N2O3/c1-5-8-10-17(7-3)15-21(16(4)9-6-2)20(23)18-11-13-19(14-12-18)22(24)25/h11-14,16-17H,5-10,15H2,1-4H3
InChIKey ITSKKUHDLJRSLQ-UHFFFAOYSA-N
Molecular Weight 348.487 g/mol
SMILES C(N(C(CCC)C)C(C1=CC=C(C=C1)N(=O)=O)=O)C(CCCC)CC