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2-(2-(trifluoromethyl)benzyl)cyclohexane-1,3-dione
SpectraBase Compound ID J34uxNCuXcx
InChI InChI=1S/C14H13F3O2/c15-14(16,17)11-5-2-1-4-9(11)8-10-12(18)6-3-7-13(10)19/h1-2,4-5,10H,3,6-8H2
InChIKey LMJVQHBDWHPFQV-UHFFFAOYSA-N
Mol Weight 270.25 g/mol
Molecular Formula C14H13F3O2
Exact Mass 270.086764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4uZM22o0Eo0
Name 2-(2-(trifluoromethyl)benzyl)cyclohexane-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13F3O2
InChI InChI=1S/C14H13F3O2/c15-14(16,17)11-5-2-1-4-9(11)8-10-12(18)6-3-7-13(10)19/h1-2,4-5,10H,3,6-8H2
InChIKey LMJVQHBDWHPFQV-UHFFFAOYSA-N
Literature Reference DOI 10.1002/asia.201100171
Molecular Weight 270.251 g/mol
SMILES C1(CCCC(C1Cc1ccccc1C(F)(F)F)=O)=O
SPLASH splash10-0fdk-1690000000-b48b80ab8ad4f2527950
Source of Spectrum CAJ-6-1344/SM5-8k
Wiley ID 1773043