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1-BENZYL-3,5-BIS-[3'(5')-METHYL-5'(3')-PYRAZOLYL]-1,2,4-TRIAZOLE
SpectraBase Compound ID CjMSdEDSfJ2
InChI InChI=1S/C19H21N7/c1-13-8-16(23-21-13)10-18-20-19(11-17-9-14(2)22-24-17)26(25-18)12-15-6-4-3-5-7-15/h3-9H,10-12H2,1-2H3,(H,21,23)(H,22,24)
InChIKey PTSBHEIWUDLENC-UHFFFAOYSA-N
Mol Weight 347.43 g/mol
Molecular Formula C19H21N7
Exact Mass 347.185844 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 308UowOetPN
Name 1-BENZYL-3,5-BIS-[3'(5')-METHYL-5'(3')-PYRAZOLYL]-1,2,4-TRIAZOLE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H21N7
InChI InChI=1S/C19H21N7/c1-13-8-16(23-21-13)10-18-20-19(11-17-9-14(2)22-24-17)26(25-18)12-15-6-4-3-5-7-15/h3-9H,10-12H2,1-2H3,(H,21,23)(H,22,24)
InChIKey PTSBHEIWUDLENC-UHFFFAOYSA-N
Literature Reference Author G.TARRAGO,C.MARZIN,O.NAJIMI,V.PELLEGRIN
Literature Reference Citation J.ORG.CHEM.,55,420(1990)
Literature Reference DOI 10.1021/jo00289a008
Molecular Weight 347.423 g/mol
Solvent CDCl3
Source File Reference UWED13532