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(1S*,3R*,4S*,5R*)3-[(Methoxycarbonyl)methyl]-5-methylene-2-oxa-4-(phenylsulfonyl)bicyclo[3.3.0]octane
SpectraBase Compound ID 8fqoXKJsRFI
InChI InChI=1S/C17H20O5S/c1-11-8-9-13-16(11)17(14(22-13)10-15(18)21-2)23(19,20)12-6-4-3-5-7-12/h3-7,13-14,16-17H,1,8-10H2,2H3/t13-,14+,16+,17+/m0/s1
InChIKey KFQOLMMCEGCZEM-XOSAIJSUSA-N
Mol Weight 336.4 g/mol
Molecular Formula C17H20O5S
Exact Mass 336.103145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AztJBooo53d
Name (1S*,3R*,4S*,5R*)3-[(Methoxycarbonyl)methyl]-5-methylene-2-oxa-4-(phenylsulfonyl)bicyclo[3.3.0]octane
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Formula C17H20O5S
InChI InChI=1S/C17H20O5S/c1-11-8-9-13-16(11)17(14(22-13)10-15(18)21-2)23(19,20)12-6-4-3-5-7-12/h3-7,13-14,16-17H,1,8-10H2,2H3/t13-,14+,16+,17+/m0/s1
InChIKey KFQOLMMCEGCZEM-XOSAIJSUSA-N
Molecular Weight 336.402 g/mol
SMILES [C@@]1(S(=O)(=O)c2ccccc2)([C@]2([C@@](CCC2=C)([H])O[C@@]1(CC(=O)OC)[H])[H])[H]
SPLASH splash10-006x-7900000000-c30aa7d23e119e173f28
Source of Spectrum F-54-1613-25
Wiley ID 805655