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Octadecyl 4-methylbenzenesulfonate
SpectraBase Compound ID GRlY4fpV4zQ
InChI InChI=1S/C25H44O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-28-29(26,27)25-21-19-24(2)20-22-25/h19-22H,3-18,23H2,1-2H3
InChIKey IZSBVVGANRHKEE-UHFFFAOYSA-N
Mol Weight 424.7 g/mol
Molecular Formula C25H44O3S
Exact Mass 424.301116 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 99IzxjoUo7v
Name TOLUENE-4-SULFONIC ACID OCTADECYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C25H44O3S
InChI InChI=1S/C25H44O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-28-29(26,27)25-21-19-24(2)20-22-25/h19-22H,3-18,23H2,1-2H3
InChIKey IZSBVVGANRHKEE-UHFFFAOYSA-N
Molecular Weight 424.3000
SMILES Cc1ccc(S(OCCCCCCCCCCCCCCCCCC)(=O)=O)cc1
SPLASH splash10-0596-9310000000-74a81a5f8ad56d6aca08
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany