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4-(2-Chloro-1,1,2-trifluoro-2-trifluoromethoxy-ethylsulfanyl)-1,5-dimethyl-2-phenyl-1,2-dihydro-pyrazol-3-one
SpectraBase Compound ID BcehIvaxKRp
InChI InChI=1S/C14H11ClF6N2O2S/c1-8-10(26-13(17,18)12(15,16)25-14(19,20)21)11(24)23(22(8)2)9-6-4-3-5-7-9/h3-7H,1-2H3
InChIKey VPSMBDFPVVSFJQ-UHFFFAOYSA-N
Mol Weight 420.76 g/mol
Molecular Formula C14H11ClF6N2O2S
Exact Mass 420.013395 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AJrmqKIQBj1
Name 4-(2-Chloro-1,1,2-trifluoro-2-trifluoromethoxy-ethylsulfanyl)-1,5-dimethyl-2-phenyl-1,2-dihydro-pyrazol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11ClF6N2O2S
InChI InChI=1S/C14H11ClF6N2O2S/c1-8-10(26-13(17,18)12(15,16)25-14(19,20)21)11(24)23(22(8)2)9-6-4-3-5-7-9/h3-7H,1-2H3
InChIKey VPSMBDFPVVSFJQ-UHFFFAOYSA-N
Molecular Weight 420.757 g/mol
SMILES C=1(C(N(c2ccccc2)N(C1C)C)=O)SC(C(OC(F)(F)F)(Cl)F)(F)F
SPLASH splash10-0a4i-9010000000-b9acba3a87251e3febc1
Synonyms 4-([2-Chloro-1,1,2-trifluoro-2-(trifluoromethoxy)ethyl]sulfanyl)-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one 4-[2-chloranyl-1,1,2-tris(fluoranyl)-2-(trifluoromethyloxy)ethyl]sulfanyl-1,5-dimethyl-2-phenyl-pyrazol-3-one 4-[2-chloro-1,1,2-trifluoro-2-(trifluoromethoxy)ethyl]sulfanyl-1,5-dimethyl-2-phenyl-pyrazol-3-one 4-[[2-chloro-1,1,2-trifluoro-2-(trifluoromethoxy)ethyl]thio]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one 4-[[2-chloro-1,1,2-trifluoro-2-(trifluoromethoxy)ethyl]thio]-1,5-dimethyl-2-phenyl-3-pyrazolone
Wiley ID 1464057