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2-(3-Methylbenzyl)cyclopentanone
SpectraBase Compound ID BYOHySmnFl1
InChI InChI=1S/C13H16O/c1-10-4-2-5-11(8-10)9-12-6-3-7-13(12)14/h2,4-5,8,12H,3,6-7,9H2,1H3
InChIKey LEBBOQGKHQZUBV-UHFFFAOYSA-N
Mol Weight 188.27 g/mol
Molecular Formula C13H16O
Exact Mass 188.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FalN6sYTY0T
Name 2-(3-Methylbenzyl)cyclopentanone
Alternate Name(s) 2-[(3-methylphenyl)methyl]-1-cyclopentanone 2-(m-tolylmethyl)cyclopentanone
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Formula C13H16O
InChI InChI=1S/C13H16O/c1-10-4-2-5-11(8-10)9-12-6-3-7-13(12)14/h2,4-5,8,12H,3,6-7,9H2,1H3
InChIKey LEBBOQGKHQZUBV-UHFFFAOYSA-N
Molecular Weight 188.270 g/mol
SMILES C1(C(Cc2cc(C)ccc2)CCC1)=O
SPLASH splash10-0aor-2900000000-9062759dc510241169fc
Source of Spectrum H-84-168-2
Wiley ID 847441