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beta-D-glucopyranoside, 1-[3-(2-chlorophenoxy)propyl]-1H-benzimidazol-2-yl 2-(acetylamino)-2-deoxy-1-thio-, 3,4,6-triacetate

View entire compound with spectra: 1 NMR

beta-D-glucopyranoside, 1-[3-(2-chlorophenoxy)propyl]-1H-benzimidazol-2-yl 2-(acetylamino)-2-deoxy-1-thio-, 3,4,6-triacetate
SpectraBase Compound ID 8eyR3Rwmj4n
InChI InChI=1S/C30H34ClN3O9S/c1-17(35)32-26-28(42-20(4)38)27(41-19(3)37)25(16-40-18(2)36)43-29(26)44-30-33-22-11-6-7-12-23(22)34(30)14-9-15-39-24-13-8-5-10-21(24)31/h5-8,10-13,25-29H,9,14-16H2,1-4H3,(H,32,35)
InChIKey WBAYQUFJSAUADP-UHFFFAOYSA-N
Mol Weight 648.1 g/mol
Molecular Formula C30H34ClN3O9S
Exact Mass 647.170429 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6RJlIfkUygL
Name beta-D-glucopyranoside, 1-[3-(2-chlorophenoxy)propyl]-1H-benzimidazol-2-yl 2-(acetylamino)-2-deoxy-1-thio-, 3,4,6-triacetate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C30H34ClN3O9S/c1-17(35)32-26-28(42-20(4)38)27(41-19(3)37)25(16-40-18(2)36)43-29(26)44-30-33-22-11-6-7-12-23(22)34(30)14-9-15-39-24-13-8-5-10-21(24)31/h5-8,10-13,25-29H,9,14-16H2,1-4H3,(H,32,35)
InChIKey WBAYQUFJSAUADP-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_4734
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: F23049; Labnumber: KUR-N0342-0121