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N-(beta-D-glucopyranosyl)thiosalicylamide, pentaacetate
SpectraBase Compound ID 6efwF2puHnm
InChI InChI=1S/C23H27NO11S/c1-11(25)30-10-18-19(32-13(3)27)20(33-14(4)28)21(34-15(5)29)22(35-18)24-23(36)16-8-6-7-9-17(16)31-12(2)26/h6-9,18-22H,10H2,1-5H3,(H,24,36)/t18-,19-,20+,21-,22-/m1/s1
InChIKey ICCLSMKSCBAEQE-QMCAAQAGSA-N
Mol Weight 525.53 g/mol
Molecular Formula C23H27NO11S
Exact Mass 525.130482 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7HVPnnhUJNm
Name N-(beta-D-glucopyranosyl)thiosalicylamide, pentaacetate
Source of Sample G. Wagner, Karl-Marx University, Leipzig, Germany
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27NO11S
InChI InChI=1S/C23H27NO11S/c1-11(25)30-10-18-19(32-13(3)27)20(33-14(4)28)21(34-15(5)29)22(35-18)24-23(36)16-8-6-7-9-17(16)31-12(2)26/h6-9,18-22H,10H2,1-5H3,(H,24,36)/t18-,19-,20+,21-,22-/m1/s1
InChIKey ICCLSMKSCBAEQE-QMCAAQAGSA-N
Instrument Name Varian A-60
Sadtler NMR Number 3714M
Solvent CDCl3
Synonyms SALICYLAMIDE, N-B-D-GLUCOPYRAN- OSYLTHIO-, PENTAACETATE, /MINUS/-, GLUCOPYRANOSE, 1-DEOXY-1-/THIOSALI- CYLAMIDO/-, PENTAACETATE, B-D-/MINUS/-,