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2-Oxo-3a,6a-dihydro-4H-cyclopenta[b]furan-3(E)-ylidenemethyl toluene-4-sulfonate
SpectraBase Compound ID Ey20H841Pmr
InChI InChI=1S/C15H14O5S/c1-10-5-7-11(8-6-10)21(17,18)19-9-13-12-3-2-4-14(12)20-15(13)16/h2,4-9,12,14H,3H2,1H3/b13-9+
InChIKey NNFLCPHXLLFLRJ-UKTHLTGXSA-N
Mol Weight 306.33 g/mol
Molecular Formula C15H14O5S
Exact Mass 306.056195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 447N4HfPwhB
Name 2-Oxo-3a,6a-dihydro-4H-cyclopenta[b]furan-3(E)-ylidenemethyl toluene-4-sulfonate
Alternate Name(s) (E)-(2-oxo-4,6a-dihydro-2H-cyclopenta[b]furan-3(3aH)-ylidene)methyl 4-methylbenzenesulfonate 2-Oxo-(3ar,6ac)-3a,6a-dihydro-4H-cyclopenta[b]furan-3(E)-ylidenemethyl toluene-4-sulfonate
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Formula C15H14O5S
InChI InChI=1S/C15H14O5S/c1-10-5-7-11(8-6-10)21(17,18)19-9-13-12-3-2-4-14(12)20-15(13)16/h2,4-9,12,14H,3H2,1H3/b13-9+
InChIKey NNFLCPHXLLFLRJ-UKTHLTGXSA-N
Molecular Weight 306.332 g/mol
SMILES C1(\C(C2C(O1)C=CC2)=C\OS(c1ccc(cc1)C)(=O)=O)=O
SPLASH splash10-000x-9700000000-004ca4c15ae71335b573
Source of Spectrum F-54-3428-15
Wiley ID 806482