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2-[N-(2-Phenyl-5-(1-chloro-1,1,2,2,3,3-hexafluoropropyl-2H-pyrazol-3-yl)amino]-4-chlorobenzoic acid
SpectraBase Compound ID SYWtO2KgZ1
InChI InChI=1S/C19H11Cl2F6N3O2/c20-10-6-7-12(16(31)32)13(8-10)28-15-9-14(17(22,23)18(24,25)19(21,26)27)29-30(15)11-4-2-1-3-5-11/h1-9,28H,(H,31,32)
InChIKey WOLRXUHRPOYWOT-UHFFFAOYSA-N
Mol Weight 498.21 g/mol
Molecular Formula C19H11Cl2F6N3O2
Exact Mass 497.013251 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2DmFsJxy2y
Name 2-[N-(2-Phenyl-5-(1-chloro-1,1,2,2,3,3-hexafluoropropyl-2H-pyrazol-3-yl)amino]-4-chlorobenzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H11Cl2F6N3O2
InChI InChI=1S/C19H11Cl2F6N3O2/c20-10-6-7-12(16(31)32)13(8-10)28-15-9-14(17(22,23)18(24,25)19(21,26)27)29-30(15)11-4-2-1-3-5-11/h1-9,28H,(H,31,32)
InChIKey WOLRXUHRPOYWOT-UHFFFAOYSA-N
Molecular Weight 498.212 g/mol
SMILES N(c1c(C(=O)O)ccc(c1)Cl)c1cc(C(C(C(F)(F)Cl)(F)F)(F)F)n[n]1-c1ccccc1
SPLASH splash10-003s-0001900000-77d31d998dbde56317ef
Source of Spectrum F-60-2901-7h
Wiley ID 1678377