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5-Fluoro NPB-22

View entire compound with spectra: 1 NMR, 2 FTIR, 1 Raman, and 4 MS (GC)

5-Fluoro NPB-22
SpectraBase Compound ID 9UcFWPB3NUw
InChI InChI=1S/C22H20FN3O2/c23-13-4-1-5-15-26-18-11-3-2-10-17(18)21(25-26)22(27)28-19-12-6-8-16-9-7-14-24-20(16)19/h2-3,6-12,14H,1,4-5,13,15H2
InChIKey DZNDVBLSHUYZLI-UHFFFAOYSA-N
Mol Weight 377.42 g/mol
Molecular Formula C22H20FN3O2
Exact Mass 377.153955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 30AnmCH81Mi
Name 5F-PB-22 indazole analogue
Alternate Name(s) Quinolin-8-yl-1-(5-fluoropentyl)-1H-indazole-3-carboxylate quinolin-8-yl 1-(5-fluoropentyl)-1H-indazole-3-carboxylate
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Formula C22H20FN3O2
InChI InChI=1S/C22H20FN3O2/c23-13-4-1-5-15-26-18-11-3-2-10-17(18)21(25-26)22(27)28-19-12-6-8-16-9-7-14-24-20(16)19/h2-3,6-12,14H,1,4-5,13,15H2
InChIKey DZNDVBLSHUYZLI-UHFFFAOYSA-N
Molecular Weight 377.419 g/mol
SMILES c1(n[n](c2ccccc12)CCCCCF)C(=O)Oc1cccc2cccnc12
SPLASH splash10-001i-3791000000-9216191046818746e751
Source of Spectrum SWG-33-4007-0
Wiley ID 1810665