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(E)-5-Fluoro-3'-(4-chlorophenyl)adamantane-2-spiro-5'-(delta.(2)-1',4',2'-oxathiazoline)
SpectraBase Compound ID IEuxrIksV7a
InChI InChI=1S/C17H17ClFNOS/c18-14-3-1-11(2-4-14)15-20-21-17(22-15)12-5-10-6-13(17)9-16(19,7-10)8-12/h1-4,10,12-13H,5-9H2/t10-,12-,13-,16-,17+/m1/s1
InChIKey IHCIANQIIOELOC-MXNCWBMWSA-N
Mol Weight 337.84 g/mol
Molecular Formula C17H17ClFNOS
Exact Mass 337.070341 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8mKpDjYfTCa
Name (E)-5-Fluoro-3'-(4-chlorophenyl)adamantane-2-spiro-5'-(delta.(2)-1',4',2'-oxathiazoline)
Alternate Name(s) (Z)-5-Fluoro-3'-(4-chlorophenyl)adamantane-2-spiro-5'-(delta.(2)-1',4',2'-oxathiazoline)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17ClFNOS
InChI InChI=1S/C17H17ClFNOS/c18-14-3-1-11(2-4-14)15-20-21-17(22-15)12-5-10-6-13(17)9-16(19,7-10)8-12/h1-4,10,12-13H,5-9H2/t10-,12-,13-,16-,17+/m1/s1
InChIKey IHCIANQIIOELOC-MXNCWBMWSA-N
Molecular Weight 337.840 g/mol
SMILES [C@]12(SC(c3ccc(cc3)Cl)=NO1)[C@]1(C[C@]3(C[C@]2(C[C@](C3)(C1)[H])[H])F)[H]
SPLASH splash10-015i-0903000000-b6b6e691f377e09c2bdd
Source of Spectrum J-64-1104-7
Wiley ID 1529381