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3-Oxobicyclo[3.3.1]nonan-1-yl 4-methylphenylsulfonate
SpectraBase Compound ID KQv1gzchxUT
InChI InChI=1S/C16H20O4S/c1-12-4-6-15(7-5-12)21(18,19)20-16-8-2-3-13(10-16)9-14(17)11-16/h4-7,13H,2-3,8-11H2,1H3
InChIKey ZBMZVSYRKLWXEY-UHFFFAOYSA-N
Mol Weight 308.39 g/mol
Molecular Formula C16H20O4S
Exact Mass 308.10823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9zBVjoajO17
Name 3-Oxobicyclo[3.3.1]nonan-1-yl 4-methylphenylsulfonate
Alternate Name(s) 3-oxobicyclo[3.3.1]non-1-yl 4-methylbenzenesulfonate
Comments Less than 3 mono-isotopic peaks
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Formula C16H20O4S
InChI InChI=1S/C16H20O4S/c1-12-4-6-15(7-5-12)21(18,19)20-16-8-2-3-13(10-16)9-14(17)11-16/h4-7,13H,2-3,8-11H2,1H3
InChIKey ZBMZVSYRKLWXEY-UHFFFAOYSA-N
Molecular Weight 308.392 g/mol
SMILES c1(ccc(cc1)C)S(=O)(=O)OC12CC(CC(CCC2)C1)=O
SPLASH splash10-0006-9001000000-8bc0992d4a506e604198
Source of Spectrum SO-1979-54-7
Wiley ID 1537260