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(R)-5-(Perfluoropentyl)-4-fluoro-5-hydroxy-2-phenylpyrazolidin-3-one
SpectraBase Compound ID Al73pJpqyvM
InChI InChI=1S/C14H8F12N2O2/c15-7-8(29)28(6-4-2-1-3-5-6)27-9(7,30)10(16,17)11(18,19)12(20,21)13(22,23)14(24,25)26/h1-5,7,27,30H/t7?,9-/m1/s1
InChIKey XZOIYVXYJOEVAU-NHSZFOGYSA-N
Mol Weight 464.21 g/mol
Molecular Formula C14H8F12N2O2
Exact Mass 464.039415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LONYdCZN0Pw
Name (R)-5-(Perfluoropentyl)-4-fluoro-5-hydroxy-2-phenylpyrazolidin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H8F12N2O2
InChI InChI=1S/C14H8F12N2O2/c15-7-8(29)28(6-4-2-1-3-5-6)27-9(7,30)10(16,17)11(18,19)12(20,21)13(22,23)14(24,25)26/h1-5,7,27,30H/t7?,9-/m1/s1
InChIKey XZOIYVXYJOEVAU-NHSZFOGYSA-N
Molecular Weight 464.211 g/mol
SMILES N1[C@](C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(=O)N1c1ccccc1)F)O
SPLASH splash10-01t9-9200700000-77d6692942ec6cd17422
Source of Spectrum SO-0-1013-3
Synonyms (5R)-4-fluoro-5-hydroxy-2-phenyl-5-(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)-3-pyrazolidinone 5-(Perfluoropentyl)-4-fluoro-5-hydroxy-1-phenylpyrazolidin-3-one
Wiley ID 1542692