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(E)-1-(4-Oxoadamantyl)-2-(4-chlorophenyl)ethene
SpectraBase Compound ID od7UEqGRG6
InChI InChI=1S/C18H19ClO/c19-16-3-1-12(2-4-16)5-6-18-9-13-7-14(10-18)17(20)15(8-13)11-18/h1-6,13-15H,7-11H2/b6-5+/t13-,14-,15+,18+
InChIKey SHGHZSFENFNUGN-ZTWFMLDRSA-N
Mol Weight 286.8 g/mol
Molecular Formula C18H19ClO
Exact Mass 286.112443 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3lqfIvldXmW
Name (E)-1-(4-Oxoadamantyl)-2-(4-chlorophenyl)ethene
Alternate Name(s) 5-[(E)-2-(4-chlorophenyl)ethenyl]-2-adamantanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19ClO
InChI InChI=1S/C18H19ClO/c19-16-3-1-12(2-4-16)5-6-18-9-13-7-14(10-18)17(20)15(8-13)11-18/h1-6,13-15H,7-11H2/b6-5+/t13-,14-,15+,18+
InChIKey SHGHZSFENFNUGN-ZTWFMLDRSA-N
Molecular Weight 286.802 g/mol
SMILES c1(\C=C\[C@]23C[C@@]4(C([C@@](C[C@](C3)(C4)[H])(C2)[H])=O)[H])ccc(cc1)Cl
SPLASH splash10-00kr-0390000000-280f13a7f5e25fe7235e
Source of Spectrum J-66-6027-14
Wiley ID 1535810