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3-(BENZOTRIAZOL-1-YL-METHYL)-HEPTAN-4-ONE
SpectraBase Compound ID KOJQ3rIwkCP
InChI InChI=1S/C14H19N3O/c1-3-7-14(18)11(4-2)10-17-13-9-6-5-8-12(13)15-16-17/h5-6,8-9,11H,3-4,7,10H2,1-2H3
InChIKey ATBUOAATYPPAQP-UHFFFAOYSA-N
Mol Weight 245.33 g/mol
Molecular Formula C14H19N3O
Exact Mass 245.152812 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L7uJskUO1sw
Name 3-(BENZOTRIAZOL-1-YL-METHYL)-HEPTAN-4-ONE
Compound Number 5 B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H19N3O
InChI InChI=1S/C14H19N3O/c1-3-7-14(18)11(4-2)10-17-13-9-6-5-8-12(13)15-16-17/h5-6,8-9,11H,3-4,7,10H2,1-2H3
InChIKey ATBUOAATYPPAQP-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 245.324 g/mol
Solvent CDCl3
Source File Reference UWCS18796