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Methyl 4-(1-methylundecyl)benzenesulphonate
SpectraBase Compound ID LkWDPk6l2kK
InChI InChI=1S/C19H32O3S/c1-4-5-6-7-8-9-10-11-12-17(2)18-13-15-19(16-14-18)23(20,21)22-3/h13-17H,4-12H2,1-3H3
InChIKey YGZUAFNBIUIBEM-UHFFFAOYSA-N
Mol Weight 340.5 g/mol
Molecular Formula C19H32O3S
Exact Mass 340.207216 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AoUjfNvAMNq
Name Methyl 4-(1-methylundecyl)benzenesulphonate
CAS Registry Number 111370-47-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H32O3S
InChI InChI=1S/C19H32O3S/c1-4-5-6-7-8-9-10-11-12-17(2)18-13-15-19(16-14-18)23(20,21)22-3/h13-17H,4-12H2,1-3H3
InChIKey YGZUAFNBIUIBEM-UHFFFAOYSA-N
Molecular Weight 340.522 g/mol
SMILES c1(S(=O)(=O)OC)ccc(cc1)C(CCCCCCCCCC)C
SPLASH splash10-0002-0940000000-1c0a02e274b5b2277186
Source of Spectrum W5-1989-8340-1
Synonyms Methyl 4-(1-methylundecyl)benzenesulfonate
Wiley ID 1335186