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1-(BENZOTRIAZOL-1-YL)-2-(BENZOTRIAZOL-1-YL-METHYL)-4,4-DIMETHYL-PENTANONE
SpectraBase Compound ID 6pOyfiEfIHC
InChI InChI=1S/C20H22N6O/c1-20(2,3)19(27)14(12-25-17-10-6-4-8-15(17)21-23-25)13-26-18-11-7-5-9-16(18)22-24-26/h4-11,14H,12-13H2,1-3H3
InChIKey ZQNVOPOXHIEVDL-UHFFFAOYSA-N
Mol Weight 362.44 g/mol
Molecular Formula C20H22N6O
Exact Mass 362.185509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CaXmqBOrphc
Name 1-(BENZOTRIAZOL-1-YL)-2-(BENZOTRIAZOL-1-YL-METHYL)-4,4-DIMETHYL-PENTANONE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H22N6O
InChI InChI=1S/C20H22N6O/c1-20(2,3)19(27)14(12-25-17-10-6-4-8-15(17)21-23-25)13-26-18-11-7-5-9-16(18)22-24-26/h4-11,14H,12-13H2,1-3H3
InChIKey ZQNVOPOXHIEVDL-UHFFFAOYSA-N
Literature Reference Author A.R.KATRITZKY,B.GALUSZKA,S.RACHWAL,M.BLACK
Literature Reference Citation J.HETCYCL.CHEM.,31,917(1994)
Literature Reference DOI 10.1002/jhet.5570310438
Molecular Weight 362.434 g/mol
Solvent CDCl3
Source File Reference UWCS18794