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N-hexadecyl-N-methyl-p-nitrobenzensulfonamide
SpectraBase Compound ID DTuQ2VEE3XF
InChI InChI=1S/C23H40N2O4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-24(2)30(28,29)23-19-17-22(18-20-23)25(26)27/h17-20H,3-16,21H2,1-2H3
InChIKey QALMORZYODYPPR-UHFFFAOYSA-N
Mol Weight 440.6 g/mol
Molecular Formula C23H40N2O4S
Exact Mass 440.270879 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9uUmoYfuBc1
Name N-Hexadecyl-N-methyl-p-nitrobenzensulfonamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 440.270878946 u
Formula C23H40N2O4S
InChI InChI=1S/C23H40N2O4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-24(2)30(28,29)23-19-17-22(18-20-23)25(26)27/h17-20H,3-16,21H2,1-2H3
InChIKey QALMORZYODYPPR-UHFFFAOYSA-N
Molecular Weight 440.643 g/mol
SMILES N(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N(CCCCCCCCCCCCCCCC)C