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6-PHENYL-3-(D-GLUCO-PENTITOL-1-YL)-7H-1,2,4-TRIAZOLO-[3,4-B]-[1,3,4]-THIADIAZINE
SpectraBase Compound ID qUqkeJDsjG
InChI InChI=1S/C15H18N4O5S/c20-6-10(21)11(22)12(23)13(24)14-16-17-15-19(14)18-9(7-25-15)8-4-2-1-3-5-8/h1-5,10-13,20-24H,6-7H2/t10-,11-,12+,13-/m0/s1
InChIKey PRZSWQZIHLCUDE-RVMXOQNASA-N
Mol Weight 366.39 g/mol
Molecular Formula C15H18N4O5S
Exact Mass 366.099791 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L9asj6sCSf1
Name 6-PHENYL-3-(D-GLUCO-PENTITOL-1-YL)-7H-1,2,4-TRIAZOLO-[3,4-B]-[1,3,4]-THIADIAZINE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H18N4O5S
InChI InChI=1S/C15H18N4O5S/c20-6-10(21)11(22)12(23)13(24)14-16-17-15-19(14)18-9(7-25-15)8-4-2-1-3-5-8/h1-5,10-13,20-24H,6-7H2/t10-,11-,12+,13-/m0/s1
InChIKey PRZSWQZIHLCUDE-RVMXOQNASA-N
Literature Reference Author A.ZHANG,L.ZHANG,X.LEI
Literature Reference Citation MAGN.RES.CHEM.,44,813(2006)
Literature Reference DOI 10.1002/mrc.1829
Molecular Weight 366.392 g/mol
Sample ID 52663
Solvent DMSO-D6