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N-Isobutyl-4-methylbenzenesulfonamide
SpectraBase Compound ID FZpR7MvMvfn
InChI InChI=1S/C11H17NO2S/c1-9(2)8-12-15(13,14)11-6-4-10(3)5-7-11/h4-7,9,12H,8H2,1-3H3
InChIKey AAJQLLWEQXLVJJ-UHFFFAOYSA-N
Mol Weight 227.32 g/mol
Molecular Formula C11H17NO2S
Exact Mass 227.098 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4XN2TLHi4s
Name N-Isobutyl-4-methylbenzenesulfonamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 227.097999963 u
Formula C11H17NO2S
InChI InChI=1S/C11H17NO2S/c1-9(2)8-12-15(13,14)11-6-4-10(3)5-7-11/h4-7,9,12H,8H2,1-3H3
InChIKey AAJQLLWEQXLVJJ-UHFFFAOYSA-N
Molecular Weight 227.322 g/mol
SMILES C1(S(NCC(C)C)(=O)=O)=CC=C(C=C1)C