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(3aS,6aR)-spiro[6,6a-dihydro-3aH-thieno[3,4-c]furan-4,2'-adamantane]-1,3-dione
SpectraBase Compound ID 3KSl9k9GV5Z
InChI InChI=1S/C15H18O3S/c16-13-11-6-19-15(12(11)14(17)18-13)9-2-7-1-8(4-9)5-10(15)3-7/h7-12H,1-6H2/t7-,8+,9-,10+,11-,12+,15?/m1/s1
InChIKey PPBHLHGNLILTST-NKDMBNMHSA-N
Mol Weight 278.37 g/mol
Molecular Formula C15H18O3S
Exact Mass 278.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8vJxOgh2Low
Name (3aS,6aR)-spiro[6,6a-dihydro-3aH-thieno[3,4-c]furan-4,2'-adamantane]-1,3-dione
Alternate Name(s) (3aS,6aR)-spiro[6,6a-dihydro-3aH-thieno[3,4-c]furan-4,2'-adamantane]-1,3-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O3S
InChI InChI=1S/C15H18O3S/c16-13-11-6-19-15(12(11)14(17)18-13)9-2-7-1-8(4-9)5-10(15)3-7/h7-12H,1-6H2/t7-,8+,9-,10+,11-,12+,15?/m1/s1
InChIKey PPBHLHGNLILTST-NKDMBNMHSA-N
Molecular Weight 278.366 g/mol
SMILES [C@]12(C3(SC[C@]2(C(=O)OC1=O)[H])[C@]1(C[C@]2(C[C@@]3(C[C@@](C1)(C2)[H])[H])[H])[H])[H]
SPLASH splash10-0fc0-0390000000-0502bfd92404fcaf69c1
Source of Spectrum Y-36-965-25
Wiley ID 762482