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2-(2-fluorobenzyl)cyclohexane-1,3-dione
SpectraBase Compound ID 3r7XUEh526G
InChI InChI=1S/C13H13FO2/c14-11-5-2-1-4-9(11)8-10-12(15)6-3-7-13(10)16/h1-2,4-5,10H,3,6-8H2
InChIKey NYXPGVVADNAQIU-UHFFFAOYSA-N
Mol Weight 220.24 g/mol
Molecular Formula C13H13FO2
Exact Mass 220.089958 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ExIAOlQvB0q
Name 2-(2-fluorobenzyl)cyclohexane-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13FO2
InChI InChI=1S/C13H13FO2/c14-11-5-2-1-4-9(11)8-10-12(15)6-3-7-13(10)16/h1-2,4-5,10H,3,6-8H2
InChIKey NYXPGVVADNAQIU-UHFFFAOYSA-N
Literature Reference DOI 10.1002/asia.201100171
Molecular Weight 220.243 g/mol
SMILES C1(=O)C(Cc2ccccc2F)C(CCC1)=O
SPLASH splash10-00di-1980000000-46206c1ceb93f3cf45d4
Source of Spectrum CAJ-6-1344/SM5-8h
Wiley ID 1773041