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2,2-BIS-(2-HYDROXY-5-CHLORO-3-NITROPHENYL)-1,1,1-TRICHLOROETHANE
SpectraBase Compound ID BoYNNQ78W9Q
InChI InChI=1S/C14H7Cl5N2O6/c15-5-1-7(12(22)9(3-5)20(24)25)11(14(17,18)19)8-2-6(16)4-10(13(8)23)21(26)27/h1-4,11,22-23H
InChIKey FFTXURLSKUFFGG-UHFFFAOYSA-N
Mol Weight 476.5 g/mol
Molecular Formula C14H7Cl5N2O6
Exact Mass 473.874674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JvvcRjFTDZ6
Name 4-Chloranyl-2-nitro-6-[2,2,2-tris(chloranyl)-1-(5-chloranyl-3-nitro-2-oxidanyl-phenyl)ethyl]phenol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H7Cl5N2O6
InChI InChI=1S/C14H7Cl5N2O6/c15-5-1-7(12(22)9(3-5)20(24)25)11(14(17,18)19)8-2-6(16)4-10(13(8)23)21(26)27/h1-4,11,22-23H
InChIKey FFTXURLSKUFFGG-UHFFFAOYSA-N
Molecular Weight 476.483 g/mol
SMILES Oc1c(C(c2c(c(cc(c2)Cl)N(=O)=O)O)C(Cl)(Cl)Cl)cc(cc1N(=O)=O)Cl
SPLASH splash10-044r-3922000000-eb775edef8ca6fd6d73e
Source of Spectrum Y-40-349-2
Synonyms 4-Chloro-2-nitro-6-[2,2,2-trichloro-1-(5-chloro-2-hydroxy-3-nitro-phenyl)ethyl]phenol
Wiley ID 1528837