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Isobutyl 2-chloro-2-(p-tolylsulfinyl)dodecanoate
SpectraBase Compound ID AKmieI5ol3T
InChI InChI=1S/C23H37ClO3S/c1-5-6-7-8-9-10-11-12-17-23(24,22(25)27-18-19(2)3)28(26)21-15-13-20(4)14-16-21/h13-16,19H,5-12,17-18H2,1-4H3
InChIKey UKCSYBAZJBDRKK-UHFFFAOYSA-N
Mol Weight 429.1 g/mol
Molecular Formula C23H37ClO3S
Exact Mass 428.215194 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2aop9XVMtHz
Name Isobutyl 2-chloro-2-(p-tolylsulfinyl)dodecanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H37ClO3S
InChI InChI=1S/C23H37ClO3S/c1-5-6-7-8-9-10-11-12-17-23(24,22(25)27-18-19(2)3)28(26)21-15-13-20(4)14-16-21/h13-16,19H,5-12,17-18H2,1-4H3
InChIKey UKCSYBAZJBDRKK-UHFFFAOYSA-N
Molecular Weight 429.059 g/mol
SMILES C(S(c1ccc(cc1)C)=O)(C(OCC(C)C)=O)(Cl)CCCCCCCCCC
SPLASH splash10-0a4i-9000000000-aa076d62423ca03ee9ca
Source of Spectrum F-50-4967-14
Synonyms isobutyl 2-chloro-2-[(4-methylphenyl)sulfinyl]dodecanoate
Wiley ID 1380704