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(2R,3R,4S,5R)-2-(acetoxymethyl)-6-(4-(3-bromo-4-methoxybenzyl)-3,5-dioxo-4,5-dihydro-1,2,4-triazin-2(3H)-yl)tetrahydro-2H-pyran-3,4,5-triyl triacetate

View entire compound with spectra: 1 NMR

(2R,3R,4S,5R)-2-(acetoxymethyl)-6-(4-(3-bromo-4-methoxybenzyl)-3,5-dioxo-4,5-dihydro-1,2,4-triazin-2(3H)-yl)tetrahydro-2H-pyran-3,4,5-triyl triacetate
SpectraBase Compound ID J5MTqlqm34r
InChI InChI=1S/C25H28BrN3O12/c1-12(30)37-11-19-21(38-13(2)31)22(39-14(3)32)23(40-15(4)33)24(41-19)29-25(35)28(20(34)9-27-29)10-16-6-7-18(36-5)17(26)8-16/h6-9,19,21-24H,10-11H2,1-5H3
InChIKey QAIRZTMCRBBBNB-UHFFFAOYSA-N
Mol Weight 642.41 g/mol
Molecular Formula C25H28BrN3O12
Exact Mass 641.085636 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ek610SxqdpH
Name (2R,3R,4S,5R)-2-(acetoxymethyl)-6-(4-(3-bromo-4-methoxybenzyl)-3,5-dioxo-4,5-dihydro-1,2,4-triazin-2(3H)-yl)tetrahydro-2H-pyran-3,4,5-triyl 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/C25H28BrN3O12/c1-12(30)37-11-19-21(38-13(2)31)22(39-14(3)32)23(40-15(4)33)24(41-19)29-25(35)28(20(34)9-27-29)10-16-6-7-18(36-5)17(26)8-16/h6-9,19,21-24H,10-11H2,1-5H3
InChIKey QAIRZTMCRBBBNB-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12409
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: 100144; Labnumber: BAD7-471; VK_ID: VK-012414
Temperature 308 °C