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1,3-Cyclohexanedione, 2-acetyl-5-(2-furanyl)-
SpectraBase Compound ID 8tjhpMri4Fj
InChI InChI=1S/C12H12O4/c1-7(13)12-9(14)5-8(6-10(12)15)11-3-2-4-16-11/h2-4,8,12H,5-6H2,1H3
InChIKey YCPHFZTXIHZWJU-UHFFFAOYSA-N
Mol Weight 220.22 g/mol
Molecular Formula C12H12O4
Exact Mass 220.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 95YLSxCYps
Name 1,3-Cyclohexanedione, 2-acetyl-5-(2-furanyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O4
InChI InChI=1S/C12H12O4/c1-7(13)12-9(14)5-8(6-10(12)15)11-3-2-4-16-11/h2-4,8,12H,5-6H2,1H3
InChIKey YCPHFZTXIHZWJU-UHFFFAOYSA-N
Molecular Weight 220.224 g/mol
SMILES C1(CC(CC(C1C(C)=O)=O)c1ccco1)=O
SPLASH splash10-0006-9210000000-775012b7ed3b95ca7e85
Source of Spectrum IY-1-4432-3
Synonyms 2-Acetyl-5-(2-furanyl)cyclohexane-1,3-dione 2-Acetyl-5-(furan-2-yl)cyclohexane-1,3-dione 2-Acetyl-5-(2-furyl)cyclohexane-1,3-dione 2-Ethanoyl-5-(furan-2-yl)cyclohexane-1,3-dione
Wiley ID 1652306