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6-(2,3-dichlorophenyl)-1-hydroxy-4-(trifluoromethyl)-1H-indole-2-carboxylic acid
SpectraBase Compound ID 6hWkrUdAHlf
InChI InChI=1S/C16H8Cl2F3NO3/c17-11-3-1-2-8(14(11)18)7-4-10(16(19,20)21)9-6-13(15(23)24)22(25)12(9)5-7/h1-6,25H,(H,23,24)
InChIKey XRKKWVXCHIEPJC-UHFFFAOYSA-N
Mol Weight 390.15 g/mol
Molecular Formula C16H8Cl2F3NO3
Exact Mass 388.983333 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9QGnmtD9vMm
Name 6-(2,3-dichlorophenyl)-1-hydroxy-4-(trifluoromethyl)-1H-indole-2-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H8Cl2F3NO3
InChI InChI=1S/C16H8Cl2F3NO3/c17-11-3-1-2-8(14(11)18)7-4-10(16(19,20)21)9-6-13(15(23)24)22(25)12(9)5-7/h1-6,25H,(H,23,24)
InChIKey XRKKWVXCHIEPJC-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 390.145 g/mol
SMILES OC(c1[n](c2cc(cc(c2c1)C(F)(F)F)-c1c(c(ccc1)Cl)Cl)O)=O
SPLASH splash10-000l-0059000000-c7a9b17afcb9fc874cc5
Source of Spectrum WO2013092753A1
Wiley ID 1847970