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2-Adamantan-1-yl-1-(4-chloro-phenyl)-4,4,4-trifluoro-butane-1,3-dione
SpectraBase Compound ID 3uESI6HEZKQ
InChI InChI=1S/C20H20ClF3O2/c21-15-3-1-14(2-4-15)17(25)16(18(26)20(22,23)24)19-8-11-5-12(9-19)7-13(6-11)10-19/h1-4,11-13,16H,5-10H2/t11-,12+,13-,16?,19-
InChIKey FWWZAPUFXXVPCO-SNPHYHEUSA-N
Mol Weight 384.83 g/mol
Molecular Formula C20H20ClF3O2
Exact Mass 384.110392 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8SQP7qXd1ig
Name 2-Adamantan-1-yl-1-(4-chloro-phenyl)-4,4,4-trifluoro-butane-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20ClF3O2
InChI InChI=1S/C20H20ClF3O2/c21-15-3-1-14(2-4-15)17(25)16(18(26)20(22,23)24)19-8-11-5-12(9-19)7-13(6-11)10-19/h1-4,11-13,16H,5-10H2/t11-,12+,13-,16?,19-
InChIKey FWWZAPUFXXVPCO-SNPHYHEUSA-N
Molecular Weight 384.826 g/mol
SMILES C12(C(C(C(F)(F)F)=O)C(c3ccc(cc3)Cl)=O)C[C@]3(C[C@@](C1)(C[C@@](C2)(C3)[H])[H])[H]
SPLASH splash10-029l-2900000000-d0613c1e7ff714ace6ee
Synonyms 2-(1-Adamantyl)-1-(4-chlorophenyl)-4,4,4-trifluoro-1,3-butanedione 2-(1-adamantyl)-1-(4-chlorophenyl)-4,4,4-trifluoro-butane-1,3-dione 2-(1-adamantyl)-1-(4-chlorophenyl)-4,4,4-tris(fluoranyl)butane-1,3-dione
Wiley ID 1460778