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2-(benzenesulfonyl)-6-methyl-6-heptenoic acid tert-butyl ester
SpectraBase Compound ID FTqbf0oZ9Au
InChI InChI=1S/C18H26O4S/c1-14(2)10-9-13-16(17(19)22-18(3,4)5)23(20,21)15-11-7-6-8-12-15/h6-8,11-12,16H,1,9-10,13H2,2-5H3
InChIKey KWTNWWODGXOSHZ-UHFFFAOYSA-N
Mol Weight 338.46 g/mol
Molecular Formula C18H26O4S
Exact Mass 338.15518 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GD8ZflravHb
Name 2-(benzenesulfonyl)-6-methyl-6-heptenoic acid tert-butyl ester
Alternate Name(s) 2-besyl-6-methyl-hept-6-enoic acid tert-butyl ester tert-Butyl 2-(benzenesulfonyl)-6-methyl-hept-6-enoate tert-Butyl 6-methyl-2-(phenylsulfonyl)hept-6-enoate
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Formula C18H26O4S
InChI InChI=1S/C18H26O4S/c1-14(2)10-9-13-16(17(19)22-18(3,4)5)23(20,21)15-11-7-6-8-12-15/h6-8,11-12,16H,1,9-10,13H2,2-5H3
InChIKey KWTNWWODGXOSHZ-UHFFFAOYSA-N
Molecular Weight 338.462 g/mol
SMILES C(S(=O)(=O)c1ccccc1)(C(OC(C)(C)C)=O)CCCC(=C)C
SPLASH splash10-05al-9720000000-95371b84a08aa182f816
Source of Spectrum SO-0-147-2
Wiley ID 864011