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2-(1-Adamantyl)-5-(4-chlorophenyl)-1,3,4-oxadiazole
SpectraBase Compound ID 4DQqSUt66MB
InChI InChI=1S/C18H19ClN2O/c19-15-3-1-14(2-4-15)16-20-21-17(22-16)18-8-11-5-12(9-18)7-13(6-11)10-18/h1-4,11-13H,5-10H2/t11-,12+,13-,18-
InChIKey UULKOPDDXSIABO-MCXHQAMOSA-N
Mol Weight 314.82 g/mol
Molecular Formula C18H19ClN2O
Exact Mass 314.118591 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JqGqvcKVpae
Name 2-(1-Adamantyl)-5-(4-chlorophenyl)-1,3,4-oxadiazole
Alternate Name(s) 2-((3r,5r,7r)-adamantan-1-yl)-5-(4-chlorophenyl)-1,3,4-oxadiazole
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Formula C18H19ClN2O
InChI InChI=1S/C18H19ClN2O/c19-15-3-1-14(2-4-15)16-20-21-17(22-16)18-8-11-5-12(9-18)7-13(6-11)10-18/h1-4,11-13H,5-10H2/t11-,12+,13-,18-
InChIKey UULKOPDDXSIABO-MCXHQAMOSA-N
Molecular Weight 314.816 g/mol
SMILES c1(C23C[C@]4(C[C@@](C3)(C[C@@](C2)(C4)[H])[H])[H])oc(-c2ccc(cc2)Cl)nn1
SPLASH splash10-01pc-4809000000-32b3c55fa1d11bd0e161
Source of Spectrum EMC-42-239-4c
Wiley ID 1735168