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AGTZNLLJZKWING-UHFFFAOYSA-O

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AGTZNLLJZKWING-UHFFFAOYSA-O
SpectraBase Compound ID 8q1MlGr3MEV
InChI InChI=1S/C14H16N3O7.C4H11N/c18-14-7-4-2-1-3-5-8(14)12-10(16(21)22)6-9(15(19)20)11(7)13(12)17(23)24;1-3-5-4-2/h6-8,11-13H,1-5H2;5H,3-4H2,1-2H3/q-1;/p+1
InChIKey AGTZNLLJZKWING-UHFFFAOYSA-O
Mol Weight 412.44 g/mol
Molecular Formula C18H28N4O7
Exact Mass 412.195799 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Wo662vwy3P
Name AGTZNLLJZKWING-UHFFFAOYSA-O
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H28N4O7
InChI InChI=1S/C14H16N3O7.C4H11N/c18-14-7-4-2-1-3-5-8(14)12-10(16(21)22)6-9(15(19)20)11(7)13(12)17(23)24;1-3-5-4-2/h6-8,11-13H,1-5H2;5H,3-4H2,1-2H3/q-1;/p+1
InChIKey AGTZNLLJZKWING-UHFFFAOYSA-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 412.443 g/mol
Solvent DMSO-D6
Source File Reference UWCS8324