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p-(Pentylsulfonyl)aniline
SpectraBase Compound ID Jd0jpgJonns
InChI InChI=1S/C11H17NO2S/c1-2-3-4-9-15(13,14)11-7-5-10(12)6-8-11/h5-8H,2-4,9,12H2,1H3
InChIKey JKHQMSHBCBPZPA-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 3dzNnRpiYJi
Name p-(Pentylsulfonyl)aniline
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/c1-2-3-4-9-15(13,14)11-7-5-10(12)6-8-11/h5-8H,2-4,9,12H2,1H3
InChIKey JKHQMSHBCBPZPA-UHFFFAOYSA-N
Molecular Weight 227.322 g/mol
SMILES NC=1C=CC(=CC1)S(=O)(=O)CCCCC