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N1-hexadecylsulfanilanilide

View entire compound with spectra: 3 NMR, and 1 FTIR

N1-hexadecylsulfanilanilide
SpectraBase Compound ID IZQjw9Y2OvO
InChI InChI=1S/C28H44N2O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-25-30(27-19-16-15-17-20-27)33(31,32)28-23-21-26(29)22-24-28/h15-17,19-24H,2-14,18,25,29H2,1H3
InChIKey JXSSLORMAQAXMK-UHFFFAOYSA-N
Mol Weight 472.7 g/mol
Molecular Formula C28H44N2O2S
Exact Mass 472.31235 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 68Yr5aqeVhv
Name N1-Hexadecylsulfanilanilide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 472.312349837 u
Formula C28H44N2O2S
InChI InChI=1S/C28H44N2O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-25-30(27-19-16-15-17-20-27)33(31,32)28-23-21-26(29)22-24-28/h15-17,19-24H,2-14,18,25,29H2,1H3
InChIKey JXSSLORMAQAXMK-UHFFFAOYSA-N
Molecular Weight 472.732 g/mol
SMILES NC=1C=CC(=CC1)S(=O)(=O)N(CCCCCCCCCCCCCCCC)C=1C=CC=CC1