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HBKGWKHDYCSMEO-UHFFFAOYSA-N

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HBKGWKHDYCSMEO-UHFFFAOYSA-N
SpectraBase Compound ID 4IKWTfVz3io
InChI InChI=1S/C13H17N3.ClH/c1-3-4-7-16-8-5-12(6-9-16)13-10-11(2)14-15-13;/h5-6,8-10H,3-4,7H2,1-2H3;1H
InChIKey HBKGWKHDYCSMEO-UHFFFAOYSA-N
Mol Weight 251.76 g/mol
Molecular Formula C13H18ClN3
Exact Mass 251.118925 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AD0fbSDRloz
Name HBKGWKHDYCSMEO-UHFFFAOYSA-N
Compound Number 129
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18ClN3
InChI InChI=1S/C13H17N3.ClH/c1-3-4-7-16-8-5-12(6-9-16)13-10-11(2)14-15-13;/h5-6,8-10H,3-4,7H2,1-2H3;1H
InChIKey HBKGWKHDYCSMEO-UHFFFAOYSA-N
Literature Reference Author M.BEGTRUP,G.BOYER,P.CABILDO,C.CATIVIELA,R.M.CLARAMUNT,J.ELGU ERO,J.I.GARCIA,C.TOI
Literature Reference Citation MAGN.RES.CHEM.,31,107(1993)
Literature Reference DOI 10.1002/mrc.1260310202
Molecular Weight 251.759 g/mol
Solvent DMSO-D6
Source File Reference UWVP1653