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2-[1-Phenylthio-2-propenyl]cyclohexyl tosylate
SpectraBase Compound ID 4gArAjuZSjs
InChI InChI=1S/C22H26O3S2/c1-3-22(26-18-9-5-4-6-10-18)20-11-7-8-12-21(20)25-27(23,24)19-15-13-17(2)14-16-19/h3-6,9-10,13-16,20-22H,1,7-8,11-12H2,2H3
InChIKey IZFDHZVLSGYFPF-UHFFFAOYSA-N
Mol Weight 402.57 g/mol
Molecular Formula C22H26O3S2
Exact Mass 402.132337 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LS7L0JElpcb
Name 2-[1-Phenylthio-2-propenyl]cyclohexyl tosylate
Alternate Name(s) 2-[1-(phenylsulfanyl)-2-propenyl]cyclohexyl 4-methylbenzenesulfonate
CAS Registry Number 131483-87-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26O3S2
InChI InChI=1S/C22H26O3S2/c1-3-22(26-18-9-5-4-6-10-18)20-11-7-8-12-21(20)25-27(23,24)19-15-13-17(2)14-16-19/h3-6,9-10,13-16,20-22H,1,7-8,11-12H2,2H3
InChIKey IZFDHZVLSGYFPF-UHFFFAOYSA-N
Molecular Weight 402.567 g/mol
SMILES C1(OS(c2ccc(cc2)C)(=O)=O)C(C(Sc2ccccc2)C=C)CCCC1
SPLASH splash10-0596-6900000000-a96dc93b30ac62eda35b
Source of Spectrum J-56-722-5
Wiley ID 1370333