6-[(beta-D-glucopyranosyl)oxy]nicotinonitrile, tetraacetate

SpectraBase Compound ID	JjsLBm1vTNg
InChI	InChI=1S/C20H22N2O10/c1-10(23)27-9-15-17(28-11(2)24)18(29-12(3)25)19(30-13(4)26)20(31-15)32-16-6-5-14(7-21)8-22-16/h5-6,8,15,17-20H,9H2,1-4H3/t15-,17-,18+,19-,20+/m1/s1
InChIKey	GFQRFMWLGPVPOY-PKOFMYQESA-N Google Search
Mol Weight	450.4 g/mol
Molecular Formula	C20H22N2O10
Exact Mass	450.127445 g/mol

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SpectraBase Spectrum ID	JVYv9Fcl6Vu
Name	6-(beta-D-GLUCOPYRANOSYLOXY)NICOTINONITRILE, TETRAACETATE
Source of Sample	G. Wagner, Karl-Marx University, Leipzig, Germany
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H22N2O10
InChI	InChI=1S/C20H22N2O10/c1-10(23)27-9-15-17(28-11(2)24)18(29-12(3)25)19(30-13(4)26)20(31-15)32-16-6-5-14(7-21)8-22-16/h5-6,8,15,17-20H,9H2,1-4H3/t15-,17-,18+,19-,20+/m1/s1
InChIKey	GFQRFMWLGPVPOY-PKOFMYQESA-N
Literature Reference	Abstract-Chemical Abstracts= 63, 1847(1965)
Melting Point	153-154.5C
Molecular Weight	450.399994
Optical Properties	Optical Rotation= (19C) 5.4 DEG (c=5.0, CHLOROFORM)
Synonyms	NICOTINONITRILE, 6-/B-D-GLUCO- PYRANOSYLOXY/-, TETRAACETATE /ESTER/, /PLUS/-, GLUCOPYRANOSIDE, 5-CYANO-2-PYRIDYL, TETRAACETATE /ESTER/, B-D-/PLUS/-,
Technique	KBr WAFER