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Benzamide, 4-nitro-N-(2-phenylethyl)-N-decyl-
SpectraBase Compound ID 53rmgbf9Bro
InChI InChI=1S/C25H34N2O3/c1-2-3-4-5-6-7-8-12-20-26(21-19-22-13-10-9-11-14-22)25(28)23-15-17-24(18-16-23)27(29)30/h9-11,13-18H,2-8,12,19-21H2,1H3
InChIKey YOQJKBHQMUYPDT-UHFFFAOYSA-N
Mol Weight 410.6 g/mol
Molecular Formula C25H34N2O3
Exact Mass 410.256943 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7bBcUC4yQ6d
Name Benzamide, 4-nitro-N-(2-phenylethyl)-N-decyl-
Comments Computed using HOSE algorithm
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Exact Mass 410.256942960 u
Formula C25H34N2O3
InChI InChI=1S/C25H34N2O3/c1-2-3-4-5-6-7-8-12-20-26(21-19-22-13-10-9-11-14-22)25(28)23-15-17-24(18-16-23)27(29)30/h9-11,13-18H,2-8,12,19-21H2,1H3
InChIKey YOQJKBHQMUYPDT-UHFFFAOYSA-N
Molecular Weight 410.558 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)C=1C=CC(=CC1)N(=O)=O)CCCCCCCCCC