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1-(4-TRIFLUOROMETHYLTHIOBENZYL)-3-TRIFLUOROMETHYLTHIO-2-METHYLINDOLIZINE
SpectraBase Compound ID 70cIeTLsJtb
InChI InChI=1S/C18H13F6NS2/c1-11-15(10-12-5-7-13(8-6-12)26-17(19,20)21)25-9-3-2-4-14(25)16(11)27-18(22,23)24/h2-9H,10H2,1H3
InChIKey JDQTXFYGWOQASG-UHFFFAOYSA-N
Mol Weight 421.42 g/mol
Molecular Formula C18H13F6NS2
Exact Mass 421.039361 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID nVDh6mpcSE
Name 1-(4-TRIFLUOROMETHYLTHIOBENZYL)-3-TRIFLUOROMETHYLTHIO-2-METHYLINDOLIZINE
Comments SCALE INVERTED
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Formula C18H13F6NS2
InChI InChI=1S/C18H13F6NS2/c1-11-15(10-12-5-7-13(8-6-12)26-17(19,20)21)25-9-3-2-4-14(25)16(11)27-18(22,23)24/h2-9H,10H2,1H3
InChIKey JDQTXFYGWOQASG-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference J.MIREK (1981) J.Fluor.Chem.: v.19, N1, 67-70.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C6F6 hexafluorobenze