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1-BUTYL-2-[(4-FLUOROPHENYL)-AMINO]-1H-1,2,4-TRIAZOLO-[2,3-B]-INDAZOLE
SpectraBase Compound ID JkSWNGS6hBK
InChI InChI=1S/C17H16FN5/c1-2-11-22-16-14-5-3-4-6-15(14)20-23(16)21-17(22)19-13-9-7-12(18)8-10-13/h3-10H,2,11H2,1H3,(H,19,21)
InChIKey PLRPUHALHGRZQH-UHFFFAOYSA-N
Mol Weight 309.35 g/mol
Molecular Formula C17H16FN5
Exact Mass 309.138974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GHWGXKWt6Mq
Name 1-BUTYL-2-[(4-FLUOROPHENYL)-AMINO]-1H-1,2,4-TRIAZOLO-[2,3-B]-INDAZOLE
CAS Registry Number 127358-36-5
Compound Number 8I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H16FN5
InChI InChI=1S/C17H16FN5/c1-2-11-22-16-14-5-3-4-6-15(14)20-23(16)21-17(22)19-13-9-7-12(18)8-10-13/h3-10H,2,11H2,1H3,(H,19,21)
InChIKey PLRPUHALHGRZQH-UHFFFAOYSA-N
Literature Reference Author P.MOLINA,A.ARQUES,M.V.VINADER
Literature Reference Citation J.ORG.CHEM.,55,4724(1990)
Literature Reference DOI 10.1021/jo00302a045
Molecular Weight 309.346 g/mol
Solvent CDCl3:DMSO-D6
Source File Reference UWCS13646