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4-Trifluoromethyl-5-hexyl-5-phenyl-1,3-dioxolane-2-thione
SpectraBase Compound ID REQTgRHZK0
InChI InChI=1S/C16H19F3O2S/c1-2-3-4-8-11-15(12-9-6-5-7-10-12)13(16(17,18)19)20-14(22)21-15/h5-7,9-10,13H,2-4,8,11H2,1H3
InChIKey MGPFWQVEDUXFNB-UHFFFAOYSA-N
Mol Weight 332.38 g/mol
Molecular Formula C16H19F3O2S
Exact Mass 332.105786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5PhBK1UOyDI
Name 4-Trifluoromethyl-5-hexyl-5-phenyl-1,3-dioxolane-2-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19F3O2S
InChI InChI=1S/C16H19F3O2S/c1-2-3-4-8-11-15(12-9-6-5-7-10-12)13(16(17,18)19)20-14(22)21-15/h5-7,9-10,13H,2-4,8,11H2,1H3
InChIKey MGPFWQVEDUXFNB-UHFFFAOYSA-N
Molecular Weight 332.381 g/mol
SMILES C1(C(OC(O1)=S)(c1ccccc1)CCCCCC)C(F)(F)F
SPLASH splash10-0f6w-2490000000-dce39134fe84b502c78f
Source of Spectrum E1-45-46-14
Synonyms (4R*,5R*)-4-Trifluoromethyl-5-hexyl-5-phenyl-1,3-dioxolane-2-thione (4R*,5S*)-4-Trifluoromethyl-5-hexyl-5-phenyl-1,3-dioxolane-2-thione 4-Hexyl-4-phenyl-5-(trifluoromethyl)-1,3-dioxolane-2-thione
Wiley ID 1553667