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UWDBFPNYYHXZPC-UICRBDHFSA-O

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UWDBFPNYYHXZPC-UICRBDHFSA-O
SpectraBase Compound ID 3YZKu2HFd7f
InChI InChI=1S/C12H12N3O8.C6H15N/c1-5(16)12(2)9(17)3-6-7(13(18)19)4-8(14(20)21)10(12)11(6)15(22)23;1-4-7(5-2)6-3/h4,6,10-11H,3H2,1-2H3;4-6H2,1-3H3/q-1;/p+1/t6-,10+,11?,12-;/m1./s1
InChIKey UWDBFPNYYHXZPC-UICRBDHFSA-O
Mol Weight 428.44 g/mol
Molecular Formula C18H28N4O8
Exact Mass 428.190714 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AZVtfjtpqoD
Name UWDBFPNYYHXZPC-UICRBDHFSA-O
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H28N4O8
InChI InChI=1S/C12H12N3O8.C6H15N/c1-5(16)12(2)9(17)3-6-7(13(18)19)4-8(14(20)21)10(12)11(6)15(22)23;1-4-7(5-2)6-3/h4,6,10-11H,3H2,1-2H3;4-6H2,1-3H3/q-1;/p+1/t6-,10+,11?,12-;/m1./s1
InChIKey UWDBFPNYYHXZPC-UICRBDHFSA-O
Literature Reference Author V.MACHACEK,A.LYCKA
Literature Reference Citation COLL.CZ.CH.COMM.,49,244(1984)
Literature Reference DOI 10.1135/cccc19840244
Molecular Weight 428.442 g/mol
Solvent DMSO-D6
Source File Reference UWCS8328