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7-(3,4-DICHLOROBENZYL)-4,8,8-TRIMETHYL-2-(PROP-2-YNYL)-7,8-DIHYDRO-IMIDAZO-[5,1-C]-[1,2,4]-TRIAZINE-3,6(2H,4H)-DIONE
SpectraBase Compound ID D62RAVAacbE
InChI InChI=1S/C18H18Cl2N4O2/c1-5-8-23-15(25)11(2)24-16(21-23)18(3,4)22(17(24)26)10-12-6-7-13(19)14(20)9-12/h1,6-7,9,11H,8,10H2,2-4H3
InChIKey RZTOXDSTNMGVET-UHFFFAOYSA-N
Mol Weight 393.27 g/mol
Molecular Formula C18H18Cl2N4O2
Exact Mass 392.080681 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G23hsioJm4k
Name 7-(3,4-DICHLOROBENZYL)-4,8,8-TRIMETHYL-2-(PROP-2-YNYL)-7,8-DIHYDRO-IMIDAZO-[5,1-C]-[1,2,4]-TRIAZINE-3,6(2H,4H)-DIONE
Compound Number 29
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H18Cl2N4O2
InChI InChI=1S/C18H18Cl2N4O2/c1-5-8-23-15(25)11(2)24-16(21-23)18(3,4)22(17(24)26)10-12-6-7-13(19)14(20)9-12/h1,6-7,9,11H,8,10H2,2-4H3
InChIKey RZTOXDSTNMGVET-UHFFFAOYSA-N
Literature Reference Author N.T.TZVETKOV,H.EULER,C.E.MUELLER
Literature Reference Citation BEIL.J.ORG.CHEM.,8,1584(2012)
Literature Reference DOI 10.3762/bjoc.8.181
Molecular Weight 393.273 g/mol
Solvent DMSO-D6
Source File Reference UWIR11221