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(E)-5-Fluoro-3'-(4-bromophenyl)-4'-hydrospiro[adamantane-2,5'-(delta.(2)-isoxazoline]
SpectraBase Compound ID KcuUehP65yS
InChI InChI=1S/C18H19BrFNO/c19-15-3-1-12(2-4-15)16-10-18(22-21-16)13-5-11-6-14(18)9-17(20,7-11)8-13/h1-4,11,13-14H,5-10H2/t11-,13-,14-,17-,18-/m1/s1
InChIKey XXBRTDWYLILBPT-TUXNIGETSA-N
Mol Weight 364.26 g/mol
Molecular Formula C18H19BrFNO
Exact Mass 363.063405 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JoTvqoKeWNP
Name (E)-5-Fluoro-3'-(4-bromophenyl)-4'-hydrospiro[adamantane-2,5'-(delta.(2)-isoxazoline]
Alternate Name(s) (Z)-5-Fluoro-3'-(4-bromophenyl)-4'-hydrospiro[adamantane-2,5'-(delta.(2)-isoxazoline]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19BrFNO
InChI InChI=1S/C18H19BrFNO/c19-15-3-1-12(2-4-15)16-10-18(22-21-16)13-5-11-6-14(18)9-17(20,7-11)8-13/h1-4,11,13-14H,5-10H2/t11-,13-,14-,17-,18-/m1/s1
InChIKey XXBRTDWYLILBPT-TUXNIGETSA-N
Molecular Weight 364.258 g/mol
SMILES [C@]12(ON=C(C2)c2ccc(cc2)Br)[C@]2(C[C@]3(C[C@]1(C[C@](C3)(C2)[H])[H])F)[H]
SPLASH splash10-04i1-0009000000-e85c5e97bc5c5863cad8
Source of Spectrum J-64-1106-8
Wiley ID 1529365