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1-(4-Chlorophenyl)-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]urea
SpectraBase Compound ID 4OiDEfa8Qiu
InChI InChI=1S/C16H11ClF6N2O2/c17-10-3-7-12(8-4-10)25-13(26)24-11-5-1-9(2-6-11)14(27,15(18,19)20)16(21,22)23/h1-8,27H,(H2,24,25,26)
InChIKey XYEQWDNGQUAEHP-UHFFFAOYSA-N
Mol Weight 412.72 g/mol
Molecular Formula C16H11ClF6N2O2
Exact Mass 412.041324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CByYdxvcwrA
Name 1-(4-Chlorophenyl)-3-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]urea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11ClF6N2O2
InChI InChI=1S/C16H11ClF6N2O2/c17-10-3-7-12(8-4-10)25-13(26)24-11-5-1-9(2-6-11)14(27,15(18,19)20)16(21,22)23/h1-8,27H,(H2,24,25,26)
InChIKey XYEQWDNGQUAEHP-UHFFFAOYSA-N
Molecular Weight 412.719 g/mol
SMILES OC(c1ccc(cc1)NC(Nc1ccc(cc1)Cl)=O)(C(F)(F)F)C(F)(F)F
SPLASH splash10-004l-2900000000-da998b93d2b62e31ea3d
Source of Spectrum IY-2-5006-5
Synonyms 1-(4-Chlorophenyl)-3-[4-[1,1,1,3,3,3-hexakis(fluoranyl)-2-oxidanyl-propan-2-yl]phenyl]urea
Wiley ID 1658048