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2-Methyl-2-(2-oxo-2-phenylethyl)-1,3-cyclopentanedione

View entire compound with spectra: 1 MS (GC)

2-Methyl-2-(2-oxo-2-phenylethyl)-1,3-cyclopentanedione
SpectraBase Compound ID DCb1Qf4jRGd
InChI InChI=1S/C14H14O3/c1-14(12(16)7-8-13(14)17)9-11(15)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3
InChIKey SJZRQOVIICYROV-UHFFFAOYSA-N
Mol Weight 230.26 g/mol
Molecular Formula C14H14O3
Exact Mass 230.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I4iMbGfNyDT
Name 2-Methyl-2-(2-oxo-2-phenylethyl)-1,3-cyclopentanedione
Alternate Name(s) 2-Methyl-2-phenacyl-cyclopentane-1,3-dione 2-Methyl-2-phenacyl-cyclopentane-1,3-quinone
CAS Registry Number 13675-03-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O3
InChI InChI=1S/C14H14O3/c1-14(12(16)7-8-13(14)17)9-11(15)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3
InChIKey SJZRQOVIICYROV-UHFFFAOYSA-N
Molecular Weight 230.263 g/mol
SMILES C1(CC(=O)c2ccccc2)(C(CCC1=O)=O)C
SPLASH splash10-0a4i-0900000000-6b24ee5bdf278abb978b
Source of Spectrum J-54-3389-6
Wiley ID 1231989