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7-(N-MORPHOLINYL)-7-ETHYL-8A-HYDROXY-4,5,8,8A-TETRAHYDRO-7-H-PYRROLO-[2.3-E]-BENZOFURAZAN-6-OXIDE
SpectraBase Compound ID K4Bd7Y9VvFz
InChI InChI=1S/2C14H20N4O4/c2*1-2-13(17-5-7-21-8-6-17)9-14(19)11(18(13)20)4-3-10-12(14)16-22-15-10/h2*19H,2-9H2,1H3
InChIKey JEADFMWPXKRSRD-UHFFFAOYSA-N
Mol Weight 616.68 g/mol
Molecular Formula C28H40N8O8
Exact Mass 616.29691 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LrgC7qbXS2D
Name 7-(N-MORPHOLINYL)-7-ETHYL-8A-HYDROXY-4,5,8,8A-TETRAHYDRO-7-H-PYRROLO-[2.3-E]-BENZOFURAZAN-6-OXIDE
Compound Number V-B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H40N8O8
InChI InChI=1S/2C14H20N4O4/c2*1-2-13(17-5-7-21-8-6-17)9-14(19)11(18(13)20)4-3-10-12(14)16-22-15-10/h2*19H,2-9H2,1H3
InChIKey JEADFMWPXKRSRD-UHFFFAOYSA-N
Literature Reference Author V.A.SAMSONOV,L.B.VOLODARSKII,I.Y.BAGRYANSKAYA,Y.V.GATILOV,K. E.LAKMAN
Literature Reference Citation CHEM.HET.COMP.,30,178(1994)
Literature Reference DOI 10.1007/bf01165008
Molecular Weight 616.674 g/mol
Solvent DMSO-D6
Source File Reference UWMZ12779