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(S)-(+)-5-Methyl-5-(4-methylphenyl)cyclopent-2-en-1-one
SpectraBase Compound ID BftirWuRhRA
InChI InChI=1S/C13H14O/c1-10-5-7-11(8-6-10)13(2)9-3-4-12(13)14/h3-8H,9H2,1-2H3/t13-/m0/s1
InChIKey IRHWVHUAYRCLIM-ZDUSSCGKSA-N
Mol Weight 186.25 g/mol
Molecular Formula C13H14O
Exact Mass 186.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2OSLFwYJJg
Name (S)-(+)-5-Methyl-5-(4-methylphenyl)cyclopent-2-en-1-one
Alternate Name(s) (5S)-5-methyl-5-(4-methylphenyl)-2-cyclopenten-1-one (5S)-5-methyl-5-(4-methylphenyl)-1-cyclopent-2-enone (5S)-5-methyl-5-(4-methylphenyl)cyclopent-2-en-1-one
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Formula C13H14O
InChI InChI=1S/C13H14O/c1-10-5-7-11(8-6-10)13(2)9-3-4-12(13)14/h3-8H,9H2,1-2H3/t13-/m0/s1
InChIKey IRHWVHUAYRCLIM-ZDUSSCGKSA-N
Molecular Weight 186.254 g/mol
SMILES [C@]1(C(C=CC1)=O)(c1ccc(cc1)C)C
SPLASH splash10-00tu-1900000000-b2ffd60acdd1c1e90cf9
Source of Spectrum J-57-3471-30
Wiley ID 1183459