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(E)-5-Fluoro-3'-(4-methoxyphenyl)adamantane-2-spiro-5'-(delta.(2)-1',4',2'-oxathiazoline)

View entire compound with spectra: 1 MS (GC)

(E)-5-Fluoro-3'-(4-methoxyphenyl)adamantane-2-spiro-5'-(delta.(2)-1',4',2'-oxathiazoline)
SpectraBase Compound ID BJ1udDoorul
InChI InChI=1S/C18H20FNO2S/c1-21-15-4-2-12(3-5-15)16-20-22-18(23-16)13-6-11-7-14(18)10-17(19,8-11)9-13/h2-5,11,13-14H,6-10H2,1H3/t11-,13-,14-,17-,18-/m1/s1
InChIKey YWDMDCUWRODQLC-TUXNIGETSA-N
Mol Weight 333.42 g/mol
Molecular Formula C18H20FNO2S
Exact Mass 333.119878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ISZ7WhaVukw
Name (E)-5-Fluoro-3'-(4-methoxyphenyl)adamantane-2-spiro-5'-(delta.(2)-1',4',2'-oxathiazoline)
Alternate Name(s) (Z)-5-Fluoro-3'-(4-methoxyphenyl)adamantane-2-spiro-5'-(delta.(2)-1',4',2'-oxathiazoline)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20FNO2S
InChI InChI=1S/C18H20FNO2S/c1-21-15-4-2-12(3-5-15)16-20-22-18(23-16)13-6-11-7-14(18)10-17(19,8-11)9-13/h2-5,11,13-14H,6-10H2,1H3/t11-,13-,14-,17-,18-/m1/s1
InChIKey YWDMDCUWRODQLC-TUXNIGETSA-N
Molecular Weight 333.421 g/mol
SMILES [C@]12(SC(c3ccc(cc3)OC)=NO1)[C@]1(C[C@@]3(C[C@]2(C[C@@](C3)(C1)[H])[H])F)[H]
SPLASH splash10-015a-0903000000-9666dbc9aa69d4a865c8
Source of Spectrum J-64-1106-7
Wiley ID 1529374