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BUTYL-3-O-(TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-BUTANOATE
SpectraBase Compound ID 5u9KA9d95WJ
InChI InChI=1S/C22H34O12/c1-7-8-9-28-18(27)10-12(2)30-22-21(33-16(6)26)20(32-15(5)25)19(31-14(4)24)17(34-22)11-29-13(3)23/h12,17,19-22H,7-11H2,1-6H3/t12-,17-,19-,20+,21-,22-/m1/s1
InChIKey WOENYSUDKXDTFT-BDJKJSAOSA-N
Mol Weight 490.5 g/mol
Molecular Formula C22H34O12
Exact Mass 490.205027 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JefY2oJpAqQ
Name BUTYL-3-O-(TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-BUTANOATE
Compound Number 2A-R
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H34O12
InChI InChI=1S/C22H34O12/c1-7-8-9-28-18(27)10-12(2)30-22-21(33-16(6)26)20(32-15(5)25)19(31-14(4)24)17(34-22)11-29-13(3)23/h12,17,19-22H,7-11H2,1-6H3/t12-,17-,19-,20+,21-,22-/m1/s1
InChIKey WOENYSUDKXDTFT-BDJKJSAOSA-N
Literature Reference Author D.KRAJEWSKI,C.DUQUE,P.SCHREIER
Literature Reference Citation PHYTOCHEM.,45,1627(1997)
Literature Reference DOI 10.1016/S0031-9422(97)00196-9
Molecular Weight 490.505 g/mol
Solvent CDCl3
Source File Reference UWSP357