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4-CHLORO-m-TOLYL beta-D-XYLOPYRANOSIDE, TRIACETATE
SpectraBase Compound ID BF4v1GK0PWX
InChI InChI=1S/C18H21ClO8/c1-9-7-13(5-6-14(9)19)27-18-17(26-12(4)22)16(25-11(3)21)15(8-23-18)24-10(2)20/h5-7,15-18H,8H2,1-4H3/t15-,16+,17-,18+/m1/s1
InChIKey XFQXVIKMVXMDBZ-XDNAFOTISA-N
Mol Weight 400.81 g/mol
Molecular Formula C18H21ClO8
Exact Mass 400.092495 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 1AAWzIgaCE8
Name 4-CHLORO-m-TOLYL beta-D-XYLOPYRANOSIDE, TRIACETATE
Source of Sample C. K. DE BRUYNE, STATE UNIVERSITY OF GHENT, GHENT, BELGIUM
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21ClO8
InChI InChI=1S/C18H21ClO8/c1-9-7-13(5-6-14(9)19)27-18-17(26-12(4)22)16(25-11(3)21)15(8-23-18)24-10(2)20/h5-7,15-18H,8H2,1-4H3/t15-,16+,17-,18+/m1/s1
InChIKey XFQXVIKMVXMDBZ-XDNAFOTISA-N
Literature Reference Abstract-Chemical Abstracts= 62, 16361(1965)
Melting Point 134-135C
Molecular Weight 400.812940
Optical Properties Optical Rotation= (25C) -45.0 DEG (c=2, CHLOROFORM)
Synonyms XYLOPYRANOSIDE, 4-CHLORO-M-TOLYL, TRIACETATE, B-D-,
Technique FILM (CAST FROM CHCl3)