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4-[(p-Chlorobenzoyl)oxy]cyclohexanone
SpectraBase Compound ID 9N3gzzv4Jvq
InChI InChI=1S/C13H13ClO3/c14-10-3-1-9(2-4-10)13(16)17-12-7-5-11(15)6-8-12/h1-4,12H,5-8H2
InChIKey IPCUCDYANYVEDI-UHFFFAOYSA-N
Mol Weight 252.7 g/mol
Molecular Formula C13H13ClO3
Exact Mass 252.055322 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KlWzuZlzQLk
Name 4-[(p-Chlorobenzoyl)oxy]cyclohexanone
Alternate Name(s) 4-Chlorobenzoic acid (4-oxocyclohexyl) ester (4-oxocyclohexyl) 4-chlorobenzoate (4-oxidanylidenecyclohexyl) 4-chloranylbenzoate
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Formula C13H13ClO3
InChI InChI=1S/C13H13ClO3/c14-10-3-1-9(2-4-10)13(16)17-12-7-5-11(15)6-8-12/h1-4,12H,5-8H2
InChIKey IPCUCDYANYVEDI-UHFFFAOYSA-N
Molecular Weight 252.697 g/mol
SMILES C(OC1CCC(CC1)=O)(c1ccc(cc1)Cl)=O
SPLASH splash10-000j-3900000000-b84c7863459cc1e814b4
Source of Spectrum J-61-5566-3e-delta
Wiley ID 1256692