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(1S)-4',5'-DIHYDRO-2,3:5,6-DI-O-ISOPROPYLIDENESPIRO-[[1,4]-ANHYDRO-D-MANNITOL-1,5'-[1,2,3]-THIADIAZOLE]
SpectraBase Compound ID 4I97oCk53Sv
InChI InChI=1S/C13H20N2O5S/c1-11(2)16-5-7(17-11)8-9-10(20-12(3,4)18-9)13(19-8)6-14-15-21-13/h7-10H,5-6H2,1-4H3/t7?,8-,9+,10+,13?/m1/s1
InChIKey VYFMMXMIXMKFQD-LCDPWCGMSA-N
Mol Weight 316.37 g/mol
Molecular Formula C13H20N2O5S
Exact Mass 316.109293 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HVP7qdMzYup
Name (1S)-4',5'-DIHYDRO-2,3:5,6-DI-O-ISOPROPYLIDENESPIRO-[[1,4]-ANHYDRO-D-MANNITOL-1,5'-[1,2,3]-THIADIAZOLE]
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H20N2O5S
InChI InChI=1S/C13H20N2O5S/c1-11(2)16-5-7(17-11)8-9-10(20-12(3,4)18-9)13(19-8)6-14-15-21-13/h7-10H,5-6H2,1-4H3/t7?,8-,9+,10+,13?/m1/s1
InChIKey VYFMMXMIXMKFQD-LCDPWCGMSA-N
Literature Reference Author M.HUERZELER,B.BERNET,T.MAEDER,A.VASELLA
Literature Reference Citation HELV.CHIM.ACTA,76,1779(1993)
Literature Reference DOI 10.1002/hlca.19930760434
Molecular Weight 316.372 g/mol
Solvent CDCl3
Source File Reference UWRK1579