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7-(N-MORPHOLINYL)-7-ETHYL-8A-HYDROXY-4,5,8,8A-TETRAHYDRO-7-H-PYRROLO-[2.3-E]-BENZOFURAZAN-3,6-DIOXIDE
SpectraBase Compound ID 2fCKd2A6vHL
InChI InChI=1S/2C14H20N4O5/c2*1-2-13(16-5-7-22-8-6-16)9-14(19)11(17(13)20)4-3-10-12(14)15-23-18(10)21/h2*19H,2-9H2,1H3
InChIKey IEAQIWHYAXSYNN-UHFFFAOYSA-N
Mol Weight 648.67 g/mol
Molecular Formula C28H40N8O10
Exact Mass 648.28674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8i5fTc5bkTo
Name 7-(N-MORPHOLINYL)-7-ETHYL-8A-HYDROXY-4,5,8,8A-TETRAHYDRO-7-H-PYRROLO-[2.3-E]-BENZOFURAZAN-3,6-DIOXIDE
Compound Number VI-B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H40N8O10
InChI InChI=1S/2C14H20N4O5/c2*1-2-13(16-5-7-22-8-6-16)9-14(19)11(17(13)20)4-3-10-12(14)15-23-18(10)21/h2*19H,2-9H2,1H3
InChIKey IEAQIWHYAXSYNN-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 648.673 g/mol
Solvent DMSO-D6
Source File Reference UWMZ12781