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1-BENZYL-3-METHYL-7-PHENYL-1H-PYRANO-[2,3-C:6,5-C]-DIPYRAZOL-4(7H)-ONE
SpectraBase Compound ID nTNfW7AxgK
InChI InChI=1S/C21H16N4O2/c1-14-18-19(26)17-12-22-25(16-10-6-3-7-11-16)20(17)27-21(18)24(23-14)13-15-8-4-2-5-9-15/h2-12H,13H2,1H3
InChIKey BHHDAHWKQYEIBM-UHFFFAOYSA-N
Mol Weight 356.39 g/mol
Molecular Formula C21H16N4O2
Exact Mass 356.127326 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IyxKXHKhdQx
Name 1-BENZYL-3-METHYL-7-PHENYL-1H-PYRANO-[2,3-C:6,5-C]-DIPYRAZOL-4(7H)-ONE
Compound Number 4G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H16N4O2
InChI InChI=1S/C21H16N4O2/c1-14-18-19(26)17-12-22-25(16-10-6-3-7-11-16)20(17)27-21(18)24(23-14)13-15-8-4-2-5-9-15/h2-12H,13H2,1H3
InChIKey BHHDAHWKQYEIBM-UHFFFAOYSA-N
Literature Reference Author B.DATTERL,N.TROESTNER,D.KUCKARSKI,W.HOLZER
Literature Reference Citation MOLECULES,15,6106(2010)
Literature Reference DOI 10.3390/molecules15096106
Solvent CDCl3
Source File Reference UWLU72420