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1-Phenyl-6-(3-thienyl)-3-(trifluoromethyl)-1H-pyrazolo[4,3-c]pyridine
SpectraBase Compound ID KLl3XCYKOA8
InChI InChI=1S/C17H10F3N3S/c18-17(19,20)16-13-9-21-14(11-6-7-24-10-11)8-15(13)23(22-16)12-4-2-1-3-5-12/h1-10H
InChIKey BEVNGRRVOCYCOD-UHFFFAOYSA-N
Mol Weight 345.34 g/mol
Molecular Formula C17H10F3N3S
Exact Mass 345.054753 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AbnoQxw1rSr
Name 1-Phenyl-6-(3-thienyl)-3-(trifluoromethyl)-1H-pyrazolo[4,3-c]pyridine
Appearance Light brown crystals
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Formula C17H10F3N3S
InChI InChI=1S/C17H10F3N3S/c18-17(19,20)16-13-9-21-14(11-6-7-24-10-11)8-15(13)23(22-16)12-4-2-1-3-5-12/h1-10H
InChIKey BEVNGRRVOCYCOD-UHFFFAOYSA-N
Instrument Name Shimadzu QP 1000
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.10.183
Molecular Weight 345.343 g/mol
Reported Formula C17H10F3N3S
SMILES c1c(cccc1)-[n]1nc(c2c1cc(nc2)-c1cscc1)C(F)(F)F
SPLASH splash10-0002-1009000000-50849babfbf28b479436
Source of Spectrum BJO-10-SM6-5b
Wiley ID 1853951