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3-beta-D-glucopyranosyl-2H-1,3-benzoxazine-2,4(3H)-dithione, tetraacetate
SpectraBase Compound ID 4GnslglE223
InChI InChI=1S/C22H23NO10S2/c1-10(24)28-9-16-17(29-11(2)25)18(30-12(3)26)19(31-13(4)27)20(32-16)23-21(34)14-7-5-6-8-15(14)33-22(23)35/h5-8,16-20H,9H2,1-4H3/t16-,17-,18+,19-,20-/m1/s1
InChIKey JQZTYARBGILNOG-OUUBHVDSSA-N
Mol Weight 525.54 g/mol
Molecular Formula C22H23NO10S2
Exact Mass 525.076338 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 8sMRAD6Vixj
Name 3-beta-D-GLUCOPYRANOSYL-2H-1,3-BENZOXAZINE-2,4(3H)-DITHIONE, TETRAACETATE
Source of Sample G. Wagner, Karl-Marx University, Leipzig, Germany
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23NO10S2
InChI InChI=1S/C22H23NO10S2/c1-10(24)28-9-16-17(29-11(2)25)18(30-12(3)26)19(31-13(4)27)20(32-16)23-21(34)14-7-5-6-8-15(14)33-22(23)35/h5-8,16-20H,9H2,1-4H3/t16-,17-,18+,19-,20-/m1/s1
InChIKey JQZTYARBGILNOG-OUUBHVDSSA-N
Literature Reference Abstract-Chemical Abstracts= 62, 16361(1965)
Melting Point 185-188C
Molecular Weight 525.543030
Optical Properties Optical Rotation= (20C) -384 DEG (c=2.5, CHLOROFORM)
Synonyms GLUCOPYRANOSE, 1-DEOXY-1-/3,4-DI- HYDRO-2,4-DITHIOXO-2H-1,3-BENZOXAZIN-3- YL/-, TETRAACETATE, B-D-/MINUS/-, BENZOXAZINE-2,4/3H/-DITHIONE, 2H-1,3-, 3-B-D-GLUCOPYRANOSYL-, TETRA- ACETATE, /MINUS/-,
Technique KBr WAFER