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1,6-Diphenyl-3-(trifluoromethyl)-1H-pyrazolo[4,3-c]pyridine 5-oxide
SpectraBase Compound ID Lgr7Pw5ReUi
InChI InChI=1S/C19H12F3N3O/c20-19(21,22)18-15-12-24(26)16(13-7-3-1-4-8-13)11-17(15)25(23-18)14-9-5-2-6-10-14/h1-12H
InChIKey ZLSZAJCQKCGYSB-UHFFFAOYSA-N
Mol Weight 355.32 g/mol
Molecular Formula C19H12F3N3O
Exact Mass 355.093247 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CSCnL7XJjaj
Name 1,6-Diphenyl-3-(trifluoromethyl)-1H-pyrazolo[4,3-c]pyridine 5-oxide
Appearance Colorless crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H12F3N3O
InChI InChI=1S/C19H12F3N3O/c20-19(21,22)18-15-12-24(26)16(13-7-3-1-4-8-13)11-17(15)25(23-18)14-9-5-2-6-10-14/h1-12H
InChIKey ZLSZAJCQKCGYSB-UHFFFAOYSA-N
Instrument Name Shimadzu QP 1000
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.10.183
Molecular Weight 355.320 g/mol
Reported Formula C19H12F3N3O
SMILES c1c(cccc1)-[n]1nc(c2c1cc([n+](c2)[O-])-c1ccccc1)C(F)(F)F
SPLASH splash10-0zi0-0009000000-df7658d9926e69d7e626
Source of Spectrum BJO-10-SM8-7a
Wiley ID 1853956