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(E)-5-FLUORO-3'-PHENYL-ADAMANTANE-2-SPIRO-(1',4',2'-OXATHIAZOLINE)
SpectraBase Compound ID IcZNBkmT8ai
InChI InChI=1S/C17H18FNOS/c18-16-8-11-6-13(9-16)17(14(7-11)10-16)20-19-15(21-17)12-4-2-1-3-5-12/h1-5,11,13-14H,6-10H2/t11-,13-,14+,16-,17-
InChIKey YFWILOPQJPJTBX-CURYQRHZSA-N
Mol Weight 303.4 g/mol
Molecular Formula C17H18FNOS
Exact Mass 303.109314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 684Rj4SWWEP
Name (Z)-5-Fluoro-3'-phenyladamantane-2-spiro-5'-(1',4',2'-oxathiazaline)
Alternate Name(s) (E)-5-Fluoro-3'-phenyladamantane-2-spiro-5'-(1',4',2'-oxathiazaline) 5-Fluoro-4'-phenylspiro[adamantane-2,2'-[1,5,3]oxathiazole]
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Formula C17H18FNOS
InChI InChI=1S/C17H18FNOS/c18-16-8-11-6-13(9-16)17(14(7-11)10-16)20-19-15(21-17)12-4-2-1-3-5-12/h1-5,11,13-14H,6-10H2/t11-,13-,14+,16-,17-
InChIKey YFWILOPQJPJTBX-CURYQRHZSA-N
Molecular Weight 303.395 g/mol
SMILES [C@]12(SC(c3ccccc3)=NO1)[C@@]1(C[C@@]3(C[C@]2(C[C@@](C3)(C1)[H])[H])F)[H]
SPLASH splash10-0f80-1905000000-7aa5f02c074415035204
Source of Spectrum J-62-4674-5
Wiley ID 1305599