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5-(Perfluorohexyl)-4-fluoro-5-hydroxy-1-phenylpyrazolidin-3-one
SpectraBase Compound ID HsmCsZGWrE5
InChI InChI=1S/C15H8F14N2O2/c16-7-8(32)30-31(6-4-2-1-3-5-6)9(7,33)10(17,18)11(19,20)12(21,22)13(23,24)14(25,26)15(27,28)29/h1-5,7,33H,(H,30,32)
InChIKey YPRBJSIDUCOCAB-UHFFFAOYSA-N
Mol Weight 514.22 g/mol
Molecular Formula C15H8F14N2O2
Exact Mass 514.036222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4lOElxIgZ1D
Name 5-(Perfluorohexyl)-4-fluoro-5-hydroxy-1-phenylpyrazolidin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H8F14N2O2
InChI InChI=1S/C15H8F14N2O2/c16-7-8(32)30-31(6-4-2-1-3-5-6)9(7,33)10(17,18)11(19,20)12(21,22)13(23,24)14(25,26)15(27,28)29/h1-5,7,33H,(H,30,32)
InChIKey YPRBJSIDUCOCAB-UHFFFAOYSA-N
Molecular Weight 514.219 g/mol
SMILES N1C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(N1c1ccccc1)O)F)=O
SPLASH splash10-01ti-8500190000-8febf1dc8d1b97ca6577
Source of Spectrum SO-0-1013-3
Synonyms 4-Fluoro-5-hydroxy-1-phenyl-5-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-3-pyrazolidinone
Wiley ID 1542691