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6,7,8,9,10,11,12,13-OCTAHYDRO-3-PHENYL-3H-1,2,3-TRIAZOLO-[4,5-B]-AZACYCLOTETRADECEN-5(4H)-ONE
SpectraBase Compound ID 3xvQ2gGyXhK
InChI InChI=1S/C17H22N4O/c22-16-13-9-4-2-1-3-8-12-15-17(18-16)21(20-19-15)14-10-6-5-7-11-14/h5-7,10-11H,1-4,8-9,12-13H2,(H,18,22)
InChIKey SHRWKOPMYFXZCX-UHFFFAOYSA-N
Mol Weight 298.39 g/mol
Molecular Formula C17H22N4O
Exact Mass 298.179361 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DK67wUSXw4F
Name 6,7,8,9,10,11,12,13-OCTAHYDRO-3-PHENYL-3H-1,2,3-TRIAZOLO-[4,5-B]-AZACYCLOTETRADECEN-5(4H)-ONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H22N4O
InChI InChI=1S/C17H22N4O/c22-16-13-9-4-2-1-3-8-12-15-17(18-16)21(20-19-15)14-10-6-5-7-11-14/h5-7,10-11H,1-4,8-9,12-13H2,(H,18,22)
InChIKey SHRWKOPMYFXZCX-UHFFFAOYSA-N
Literature Reference Author V.I.OGNYANOV,M.HESSE
Literature Reference Citation HELV.CHIM.ACTA,74,899(1991)
Literature Reference DOI 10.1002/hlca.19910740421
Molecular Weight 298.388 g/mol
Solvent CDCl3
Source File Reference UWVP5376