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2-(4,4,5,5,5-pentafluoro-3-oxopentanoyl)benzoic acid
SpectraBase Compound ID LP7pFvAhojh
InChI InChI=1S/C12H7F5O4/c13-11(14,12(15,16)17)9(19)5-8(18)6-3-1-2-4-7(6)10(20)21/h1-4H,5H2,(H,20,21)
InChIKey CEWSBHFJOIOQGM-UHFFFAOYSA-N
Mol Weight 310.18 g/mol
Molecular Formula C12H7F5O4
Exact Mass 310.02645 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KjA8HjK3iUN
Name 2-(4,4,5,5,5-pentafluoro-3-oxopentanoyl)benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H7F5O4
InChI InChI=1S/C12H7F5O4/c13-11(14,12(15,16)17)9(19)5-8(18)6-3-1-2-4-7(6)10(20)21/h1-4H,5H2,(H,20,21)
InChIKey CEWSBHFJOIOQGM-UHFFFAOYSA-N
Molecular Weight 310.176 g/mol
SMILES OC(c1c(C(CC(C(C(F)(F)F)(F)F)=O)=O)cccc1)=O
SPLASH splash10-0002-1920000000-e17784cf5fd0d0f2fa40
Source of Spectrum B-54-340-3
Synonyms 2-(4,4,5,5,5-pentafluoro-1,3-dioxopentyl)benzoic acid 2-(4,4,5,5,5-pentafluoro-3-oxo-pentanoyl)benzoic acid 2-[4,4,5,5,5-pentakis(fluoranyl)-3-oxidanylidene-pentanoyl]benzoic acid
Wiley ID 840860