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methyl 6-(3,4-dichlorophenyl)-1-hydroxy-4-(trifluoromethyl)-1H-indole-2-carboxylate
SpectraBase Compound ID DXxUIdzVVOQ
InChI InChI=1S/C17H10Cl2F3NO3/c1-26-16(24)15-7-10-11(17(20,21)22)4-9(6-14(10)23(15)25)8-2-3-12(18)13(19)5-8/h2-7,25H,1H3
InChIKey PRXWPBNXBWVDLV-UHFFFAOYSA-N
Mol Weight 404.17 g/mol
Molecular Formula C17H10Cl2F3NO3
Exact Mass 402.998983 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IaiIatQmfOb
Name methyl 6-(3,4-dichlorophenyl)-1-hydroxy-4-(trifluoromethyl)-1H-indole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H10Cl2F3NO3
InChI InChI=1S/C17H10Cl2F3NO3/c1-26-16(24)15-7-10-11(17(20,21)22)4-9(6-14(10)23(15)25)8-2-3-12(18)13(19)5-8/h2-7,25H,1H3
InChIKey PRXWPBNXBWVDLV-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 404.172 g/mol
SMILES O[n]1c(cc2c(cc(cc12)-c1cc(c(cc1)Cl)Cl)C(F)(F)F)C(=O)OC
SPLASH splash10-0f9l-0039300000-a4f6d5cbed554f60d96c
Source of Spectrum WO2013092753A1
Wiley ID 1847963