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1,3-DI-(3'-CHLOROMETHYL-5'-METHYL-1'-PYRAZOLYL)-PROPANE
SpectraBase Compound ID 4gpcGfMU8Cn
InChI InChI=1S/C13H18Cl2N4/c1-10-6-12(8-14)16-18(10)4-3-5-19-11(2)7-13(9-15)17-19/h6-7H,3-5,8-9H2,1-2H3
InChIKey KNKCMPPZFGJVJO-UHFFFAOYSA-N
Mol Weight 301.22 g/mol
Molecular Formula C13H18Cl2N4
Exact Mass 300.090852 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HwiYTueZ9Q0
Name 1,3-DI-(3'-CHLOROMETHYL-5'-METHYL-1'-PYRAZOLYL)-PROPANE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18Cl2N4
InChI InChI=1S/C13H18Cl2N4/c1-10-6-12(8-14)16-18(10)4-3-5-19-11(2)7-13(9-15)17-19/h6-7H,3-5,8-9H2,1-2H3
InChIKey KNKCMPPZFGJVJO-UHFFFAOYSA-N
Literature Reference Author J.E.BOL,B.MAASE,G.GONESH,W.L.DRIESSEN,K.GOUBITZ,J.REEDIJK
Literature Reference Citation HETEROCYCLES,45,1477(1997)
Literature Reference DOI 10.3987/COM-97-7772
Molecular Weight 301.219 g/mol
Solvent CDCl3
Source File Reference UWCP5046