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1-O-BUTYRYL-(1S,6S,7R,8R,8AR)-1,6,7,8-TETRAHYDROXYOCTAHYDROINDOLIZINE;1-O-BUTYRYLCASTANOSPERMINE
SpectraBase Compound ID AWawl3zrNKL
InChI InChI=1S/C12H21NO5/c1-2-3-9(15)18-8-4-5-13-6-7(14)11(16)12(17)10(8)13/h7-8,10-12,14,16-17H,2-6H2,1H3/t7-,8-,10+,11+,12+/m0/s1
InChIKey MIANLSLDYWCVDY-VWNXEWBOSA-N
Mol Weight 259.3 g/mol
Molecular Formula C12H21NO5
Exact Mass 259.141973 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5GD1RgT3GBo
Name 1-O-BUTYRYL-(1S,6S,7R,8R,8AR)-1,6,7,8-TETRAHYDROXYOCTAHYDROINDOLIZINE;1-O-BUTYRYLCASTANOSPERMINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H21NO5
InChI InChI=1S/C12H21NO5/c1-2-3-9(15)18-8-4-5-13-6-7(14)11(16)12(17)10(8)13/h7-8,10-12,14,16-17H,2-6H2,1H3/t7-,8-,10+,11+,12+/m0/s1
InChIKey MIANLSLDYWCVDY-VWNXEWBOSA-N
Literature Reference Author A.L.MARGOLIN,D.L.DELINCK,M.R.WHALON
Literature Reference Citation J.AM.CHEM.SOC.,112,2849(1990)
Literature Reference DOI 10.1021/ja00164a001
Molecular Weight 259.302 g/mol
Solvent CDCl3
Source File Reference UWRU6541