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DENSBRKGDVVNKU-LJYOZPSBSA-N
SpectraBase Compound ID 7xRNxV7iWe4
InChI InChI=1S/C13H24N3O10PS/c1-6(17)13(27(24,25)26)28-5-8(11(21)15-4-10(19)20)16-9(18)3-2-7(14)12(22)23/h6-8,13,17H,2-5,14H2,1H3,(H,15,21)(H,16,18)(H,19,20)(H,22,23)(H2,24,25,26)/t6-,7+,8-,13+/m1/s1
InChIKey DENSBRKGDVVNKU-LJYOZPSBSA-N
Mol Weight 445.38 g/mol
Molecular Formula C13H24N3O10PS
Exact Mass 445.092002 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kp71KJPJFzL
Name DENSBRKGDVVNKU-LJYOZPSBSA-N
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H22N3O10PS
InChI InChI=1S/C13H24N3O10PS/c1-6(17)13(27(24,25)26)28-5-8(11(21)15-4-10(19)20)16-9(18)3-2-7(14)12(22)23/h6-8,13,17H,2-5,14H2,1H3,(H,15,21)(H,16,18)(H,19,20)(H,22,23)(H2,24,25,26)/t6-,7+,8-,13+/m1/s1
InChIKey DENSBRKGDVVNKU-LJYOZPSBSA-N
Literature Reference Author B.A.BERNAT,L.T.ALUGHLIN,R.N.ARMSTRONG
Literature Reference Citation J.ORG.CHEM.,63,3778(1998)
Literature Reference DOI 10.1021/jo980014b
Molecular Weight 443.366 g/mol
Sample ID 37368
Solvent D2O;PD=8.4