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1,3,5-TRIS-(N-METHYLPIPERAZINOMETHYL)-2,4-DIOXOHEXAHYDRO-1,3,5-TRIAZINE
SpectraBase Compound ID JeilyT5Ofwp
InChI InChI=1S/C21H41N9O2/c1-22-4-10-25(11-5-22)16-28-19-29(17-26-12-6-23(2)7-13-26)21(32)30(20(28)31)18-27-14-8-24(3)9-15-27/h4-19H2,1-3H3
InChIKey LLQAHJZZWOAMRP-UHFFFAOYSA-N
Mol Weight 451.6 g/mol
Molecular Formula C21H41N9O2
Exact Mass 451.338322 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4mFqMqh4rEh
Name 1,3,5-TRIS-(N-METHYLPIPERAZINOMETHYL)-2,4-DIOXOHEXAHYDRO-1,3,5-TRIAZINE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H41N9O2
InChI InChI=1S/C21H41N9O2/c1-22-4-10-25(11-5-22)16-28-19-29(17-26-12-6-23(2)7-13-26)21(32)30(20(28)31)18-27-14-8-24(3)9-15-27/h4-19H2,1-3H3
InChIKey LLQAHJZZWOAMRP-UHFFFAOYSA-N
Literature Reference Author H.SCHMIDT,M.STAEHR
Literature Reference Citation MH.CHEM.,128,475(1997)
Literature Reference DOI 10.1007/BF00806856
Molecular Weight 451.616 g/mol
Solvent CDCl3
Source File Reference UWRK2899