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Dispiro[adamantane-2,2'-thietane-3',1''-[2,4,6]cycloheptatrien]-4'-one
SpectraBase Compound ID 2SYQY3tcByC
InChI InChI=1S/C18H20OS/c19-16-17(5-3-1-2-4-6-17)18(20-16)14-8-12-7-13(10-14)11-15(18)9-12/h1-6,12-15H,7-11H2/t12-,13+,14-,15+,18-
InChIKey OUZMNEMSZSGLEX-NYDXYTTESA-N
Mol Weight 284.42 g/mol
Molecular Formula C18H20OS
Exact Mass 284.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1D6Q2BcfZY
Name Dispiro[adamantane-2,2'-thietane-3',1''-[2,4,6]cycloheptatrien]-4'-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20OS
InChI InChI=1S/C18H20OS/c19-16-17(5-3-1-2-4-6-17)18(20-16)14-8-12-7-13(10-14)11-15(18)9-12/h1-6,12-15H,7-11H2/t12-,13+,14-,15+,18-
InChIKey OUZMNEMSZSGLEX-NYDXYTTESA-N
Literature Reference DOI 10.1002/cber.19841170711
Molecular Weight 284.417 g/mol
SMILES C=1C=CC2(C=CC1)C(SC21[C@]2(C[C@@]3(C[C@](C2)(C[C@]1(C3)[H])[H])[H])[H])=O
SPLASH splash10-014l-8900000000-bdbcaf89d2869d37c579
Source of Spectrum K-117-2403-22
Synonyms (1r,3r,5r,7r)-dispiro[adamantane-2,2'-thietane-3',1''-cycloheptane]-2'',4'',6''-trien-4'-one (1R,3S,5r,7r)-dispiro[adamantane-2,2'-thietane-3',1''-cycloheptane]-2'',4'',6''-trien-4'-one
Wiley ID 1792029