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4,4-Difluoro-4-(3-ketocyclohexyl)butyric acid ethyl ester
SpectraBase Compound ID KPytSJFNIx5
InChI InChI=1S/C12H18F2O3/c1-2-17-11(16)6-7-12(13,14)9-4-3-5-10(15)8-9/h9H,2-8H2,1H3
InChIKey LYPGXYBKVBHEKU-UHFFFAOYSA-N
Mol Weight 248.27 g/mol
Molecular Formula C12H18F2O3
Exact Mass 248.122401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7OSnx2YxXsT
Name 4,4-Difluoro-4-(3-ketocyclohexyl)butyric acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18F2O3
InChI InChI=1S/C12H18F2O3/c1-2-17-11(16)6-7-12(13,14)9-4-3-5-10(15)8-9/h9H,2-8H2,1H3
InChIKey LYPGXYBKVBHEKU-UHFFFAOYSA-N
Molecular Weight 248.270 g/mol
SMILES C(C1CC(=O)CCC1)(CCC(=O)OCC)(F)F
SPLASH splash10-004j-0190000000-e62f7eca5e331fcc12ea
Source of Spectrum KC-0-1113-6
Synonyms 4,4-Difluoro-4-(3-oxocyclohexyl)butanoic acid ethyl ester Ethyl 4,4-bis(fluoranyl)-4-(3-oxidanylidenecyclohexyl)butanoate Ethyl 4,4-difluoro-4-(3-oxocyclohexyl)butanoate
Wiley ID 781215