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4-Methyl-N-(4-methylpent-3-enyl)-N-[(2S)-1-oxidanyl-3-phenyl-propan-2-yl]benzenesulfonamide
SpectraBase Compound ID H6MWesson56
InChI InChI=1S/C22H29NO3S/c1-18(2)8-7-15-23(21(17-24)16-20-9-5-4-6-10-20)27(25,26)22-13-11-19(3)12-14-22/h4-6,8-14,21,24H,7,15-17H2,1-3H3/t21-/m0/s1
InChIKey FBYQQHWEMDEPOL-NRFANRHFSA-N
Mol Weight 387.54 g/mol
Molecular Formula C22H29NO3S
Exact Mass 387.186815 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FLEkf8Od49K
Name 4-Methyl-N-(4-methylpent-3-enyl)-N-[(2S)-1-oxidanyl-3-phenyl-propan-2-yl]benzenesulfonamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 387.186814969 u
Formula C22H29NO3S
InChI InChI=1S/C22H29NO3S/c1-18(2)8-7-15-23(21(17-24)16-20-9-5-4-6-10-20)27(25,26)22-13-11-19(3)12-14-22/h4-6,8-14,21,24H,7,15-17H2,1-3H3/t21-/m0/s1
InChIKey FBYQQHWEMDEPOL-NRFANRHFSA-N
Molecular Weight 387.538 g/mol
SMILES [C@@](N(S(C=1C=CC(=CC1)C)(=O)=O)CCC=C(C)C)(CC1=CC=CC=C1)(CO)[H]