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6-Butyl-1-phenyl-3-(trifluoromethyl)-1H-pyrazolo[4,3-c]pyridine
SpectraBase Compound ID Jl6DmWoDKgf
InChI InChI=1S/C17H16F3N3/c1-2-3-7-12-10-15-14(11-21-12)16(17(18,19)20)22-23(15)13-8-5-4-6-9-13/h4-6,8-11H,2-3,7H2,1H3
InChIKey NCAZGEQTINMDEM-UHFFFAOYSA-N
Mol Weight 319.33 g/mol
Molecular Formula C17H16F3N3
Exact Mass 319.129632 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KDu9VQjeVIY
Name 6-Butyl-1-phenyl-3-(trifluoromethyl)-1H-pyrazolo[4,3-c]pyridine
Appearance Brownish oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16F3N3
InChI InChI=1S/C17H16F3N3/c1-2-3-7-12-10-15-14(11-21-12)16(17(18,19)20)22-23(15)13-8-5-4-6-9-13/h4-6,8-11H,2-3,7H2,1H3
InChIKey NCAZGEQTINMDEM-UHFFFAOYSA-N
Instrument Name Shimadzu QP 1000
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.10.183
Molecular Weight 319.331 g/mol
Reported Formula C17H16F3N3
SMILES c1c(cccc1)-[n]1nc(c2c1cc(nc2)CCCC)C(F)(F)F
SPLASH splash10-004i-1090000000-07d92911f6451c1107b2
Source of Spectrum BJO-10-SM6-5c
Wiley ID 1853952