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Benzenesulfonic acid, hexadecyl ester

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Benzenesulfonic acid, hexadecyl ester
SpectraBase Compound ID DokjMRRu75J
InChI InChI=1S/C22H38O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-21-25-26(23,24)22-19-16-15-17-20-22/h15-17,19-20H,2-14,18,21H2,1H3
InChIKey WZXYXXWJPMLRGG-UHFFFAOYSA-N
Mol Weight 382.6 g/mol
Molecular Formula C22H38O3S
Exact Mass 382.254166 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6xPmnQ89lxe
Name Benzenesulfonic acid, hexadecyl ester
CAS Registry Number 131060-12-3
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H38O3S
InChI InChI=1S/C22H38O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-21-25-26(23,24)22-19-16-15-17-20-22/h15-17,19-20H,2-14,18,21H2,1H3
InChIKey WZXYXXWJPMLRGG-UHFFFAOYSA-N
Instrument Name Varian CFT-20
SMILES c1ccccc1S(=O)(=O)OCCCCCCCCCCCCCCCC
Sadtler NMR Number 51769M
Solvent CDCl3
Synonyms Hexadecyl benzenesulfonate