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cis-3-(tert-Butyl)-5-chloro-2-methyl-4-phenylcyclopent-2-enone
SpectraBase Compound ID 8h8LW8zZOTZ
InChI InChI=1S/C16H19ClO/c1-10-13(16(2,3)4)12(14(17)15(10)18)11-8-6-5-7-9-11/h5-9,12,14H,1-4H3/t12-,14-/m1/s1
InChIKey YWOXWVSTTLGUAY-TZMCWYRMSA-N
Mol Weight 262.78 g/mol
Molecular Formula C16H19ClO
Exact Mass 262.112443 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HKpXwOlJGFw
Name cis-3-(tert-Butyl)-5-chloro-2-methyl-4-phenylcyclopent-2-enone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19ClO
InChI InChI=1S/C16H19ClO/c1-10-13(16(2,3)4)12(14(17)15(10)18)11-8-6-5-7-9-11/h5-9,12,14H,1-4H3/t12-,14-/m1/s1
InChIKey YWOXWVSTTLGUAY-TZMCWYRMSA-N
Molecular Weight 262.780 g/mol
SMILES C1(=C(C(=O)[C@@]([C@@]1(c1ccccc1)[H])(Cl)[H])C)C(C)(C)C
SPLASH splash10-000j-1970000000-359a76ec2ddc301f21b7
Source of Spectrum F-69-7063-8d
Synonyms (4R,5R)-3-(tert-butyl)-5-chloro-2-methyl-4-phenylcyclopent-2-enone
Wiley ID 1738499