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1,1-Dicarbomethoxyl-3-methyl-3-p-toluenesulfonylmethyl-4-vinylcyclopentane isomer
SpectraBase Compound ID 2N3fHKAARIW
InChI InChI=1S/C20H26O6S/c1-6-15-11-20(17(21)25-4,18(22)26-5)12-19(15,3)13-27(23,24)16-9-7-14(2)8-10-16/h6-10,15H,1,11-13H2,2-5H3
InChIKey TXDGCZSHGXAXQL-UHFFFAOYSA-N
Mol Weight 394.48 g/mol
Molecular Formula C20H26O6S
Exact Mass 394.14501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1lkhttGtYfv
Name 1,1-Dicarbomethoxyl-3-methyl-3-p-toluenesulfonylmethyl-4-vinylcyclopentane isomer
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Formula C20H26O6S
InChI InChI=1S/C20H26O6S/c1-6-15-11-20(17(21)25-4,18(22)26-5)12-19(15,3)13-27(23,24)16-9-7-14(2)8-10-16/h6-10,15H,1,11-13H2,2-5H3
InChIKey TXDGCZSHGXAXQL-UHFFFAOYSA-N
Molecular Weight 394.482 g/mol
SMILES C1(CC(CS(c2ccc(cc2)C)(=O)=O)(C)C(C1)C=C)(C(=O)OC)C(=O)OC
SPLASH splash10-0ugi-0309000000-338ac61428a794c993f7
Source of Spectrum QA-37-93-5
Synonyms 1,1-Dicarbomethoxyl-3-methyl-3-p-toluenesulfonylmethyl-4-vinylcyclopentane Dimethyl 3-methyl-3-{[(4-methylphenyl)sulfonyl]methyl}-4-vinyl-1,1-cyclopentanedicarboxylate
Wiley ID 861118