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4-(1,3-benzodioxol-5-yl)-1-[3-(trifluoromethyl)phenyl]-4-imidazoline-2-thione
SpectraBase Compound ID 8gSmmlZM2v2
InChI InChI=1S/C17H11F3N2O2S/c18-17(19,20)11-2-1-3-12(7-11)22-8-13(21-16(22)25)10-4-5-14-15(6-10)24-9-23-14/h1-8H,9H2,(H,21,25)
InChIKey UGCHBAYOWWLNMD-UHFFFAOYSA-N
Mol Weight 364.34 g/mol
Molecular Formula C17H11F3N2O2S
Exact Mass 364.049333 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4DOTV7Dh3ZU
Name 4-(1,3-benzodioxol-5-yl)-1-[3-(trifluoromethyl)phenyl]-4-imidazoline-2-thione
Alternate Name(s) 5-(1,3-benzodioxol-5-yl)-3-[3-(trifluoromethyl)phenyl]-1H-imidazole-2-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H11F3N2O2S
InChI InChI=1S/C17H11F3N2O2S/c18-17(19,20)11-2-1-3-12(7-11)22-8-13(21-16(22)25)10-4-5-14-15(6-10)24-9-23-14/h1-8H,9H2,(H,21,25)
InChIKey UGCHBAYOWWLNMD-UHFFFAOYSA-N
Molecular Weight 364.342 g/mol
SMILES N1C(=CN(C1=S)c1cc(C(F)(F)F)ccc1)c1cc2OCOc2cc1
SPLASH splash10-03dj-9815000000-4cfee90b0fa821049e5e
Wiley ID 1444998