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3,5-Heptanedione, 4-acetyl-2,2,6,6-tetramethyl-

View entire compound with spectra: 2 MS (GC)

3,5-Heptanedione, 4-acetyl-2,2,6,6-tetramethyl-
SpectraBase Compound ID HiBLzZgIhYw
InChI InChI=1S/C13H22O3/c1-8(14)9(10(15)12(2,3)4)11(16)13(5,6)7/h9H,1-7H3
InChIKey IFBGBXGWLLDOKX-UHFFFAOYSA-N
Mol Weight 226.32 g/mol
Molecular Formula C13H22O3
Exact Mass 226.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K8cdRaTrT65
Name 3,5-Heptanedione, 4-acetyl-2,2,6,6-tetramethyl-
Alternate Name(s) 4-Acetyl-2,2,6,6-tetramethyl-3,5-heptanedione 4-Acetyl-2,2,6,6-tetramethyl-heptane-3,5-dione 4-Ethanoyl-2,2,6,6-tetramethyl-heptane-3,5-dione
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Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-8(14)9(10(15)12(2,3)4)11(16)13(5,6)7/h9H,1-7H3
InChIKey IFBGBXGWLLDOKX-UHFFFAOYSA-N
Molecular Weight 226.316 g/mol
SMILES C(=O)(C(C)(C)C)C(C(=O)C(C)(C)C)C(=O)C
SPLASH splash10-052r-9200000000-7dd4a7d4780b0f1fb0c4
Wiley ID 1493502