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(E)-5-CHLORO-3'-PHENYL-4'-HYDROXYSPIRO-(ADAMANTANE-2:5'-DELTA(2)-ISOXAZOLINE)
SpectraBase Compound ID QWwrXkBrTX
InChI InChI=1S/C18H20ClNO/c19-17-8-12-6-14(9-17)18(15(7-12)10-17)11-16(20-21-18)13-4-2-1-3-5-13/h1-5,12,14-15H,6-11H2/t12-,14-,15+,17-,18+
InChIKey YRFUULGLYXUBHB-YPDBZUBKSA-N
Mol Weight 301.82 g/mol
Molecular Formula C18H20ClNO
Exact Mass 301.123342 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2GGcq0WJVdW
Name (Z)-5-Chloro-3'-phenyl-4'-hydrospiro[adamantane-2:5'-.delta.-(2)-isoxazoline]
Alternate Name(s) (E)-5-Chloro-3'-phenyl-4'-hydrospiro[adamantane-2:5'-.delta.-(2)-isoxazoline] 5-Chloro-4'-phenyl-3'H-spiro[adamantane-2,2'-[1,5]oxazole]
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Formula C18H20ClNO
InChI InChI=1S/C18H20ClNO/c19-17-8-12-6-14(9-17)18(15(7-12)10-17)11-16(20-21-18)13-4-2-1-3-5-13/h1-5,12,14-15H,6-11H2/t12-,14-,15+,17-,18+
InChIKey YRFUULGLYXUBHB-YPDBZUBKSA-N
Molecular Weight 301.817 g/mol
SMILES [C@]12(ON=C(C2)c2ccccc2)[C@]2(C[C@@]3(C[C@@]1(C[C@@](C3)(C2)[H])[H])Cl)[H]
SPLASH splash10-004i-9112000000-48e934d845693e39c315
Source of Spectrum J-62-4675-6
Wiley ID 1303921