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12,13-Dioxatricyclo[7.3.1.0(1,6)]tridecane-8-carboxylic acid, 6-methyl-5-{[4-methylphenyl)sulfonyl]oxy}-, methyl ester
SpectraBase Compound ID 92faFS1JTVm
InChI InChI=1S/C21H28O7S/c1-14-6-8-15(9-7-14)29(23,24)28-18-5-4-11-21-20(18,2)13-16(19(22)25-3)17(27-21)10-12-26-21/h6-9,16-18H,4-5,10-13H2,1-3H3
InChIKey UJECMWCZHJHZAG-UHFFFAOYSA-N
Mol Weight 424.51 g/mol
Molecular Formula C21H28O7S
Exact Mass 424.155574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2kZiD15dnjF
Name 12,13-Dioxatricyclo[7.3.1.0(1,6)]tridecane-8-carboxylic acid, 6-methyl-5-{[4-methylphenyl)sulfonyl]oxy}-, methyl ester
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Formula C21H28O7S
InChI InChI=1S/C21H28O7S/c1-14-6-8-15(9-7-14)29(23,24)28-18-5-4-11-21-20(18,2)13-16(19(22)25-3)17(27-21)10-12-26-21/h6-9,16-18H,4-5,10-13H2,1-3H3
InChIKey UJECMWCZHJHZAG-UHFFFAOYSA-N
Molecular Weight 424.508 g/mol
SMILES c1(ccc(C)cc1)S(=O)(=O)OC1CCCC23C1(C)CC(C(CCO3)O2)C(=O)OC
SPLASH splash10-0udi-9750000000-b777637e6f8074858a4f
Synonyms 12,13-Dioxatricyclo[7.3.1.0(1,6)]tridecane, 10-methoxycarbonyl-5-(4-methylphenylsulfonyloxy)-6-methyl- 6-Methyl-5-(toluene-4-sulfonyloxy)-12,13-dioxa-tricyclo[7.3.1.0(1,6)]tridecane-8-carboxylic acid methyl ester Methyl 6-methyl-5-{[(4-methylphenyl)sulfonyl]oxy}-12,13-dioxatricyclo[7.3.1.0(1,6)]tridecane-8-carboxylate
Wiley ID 1478513