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7-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1,3-dimethyl-8-sulfanyl-3,7-dihydro-1H-purine-2,6-dione

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7-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1,3-dimethyl-8-sulfanyl-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID 4RYO2V3neLo
InChI InChI=1S/C16H16N4O4S/c1-18-13-12(14(21)19(2)16(18)22)20(15(25)17-13)8-9-3-4-10-11(7-9)24-6-5-23-10/h3-4,7H,5-6,8H2,1-2H3,(H,17,25)
InChIKey BPLWOSKBHBLMDY-UHFFFAOYSA-N
Mol Weight 360.39 g/mol
Molecular Formula C16H16N4O4S
Exact Mass 360.089226 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DUzbPs33tAN
Name 7-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1,3-dimethyl-8-sulfanyl-3,7-dihydro-1H-purine-2,6-dione
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/C16H16N4O4S/c1-18-13-12(14(21)19(2)16(18)22)20(15(25)17-13)8-9-3-4-10-11(7-9)24-6-5-23-10/h3-4,7H,5-6,8H2,1-2H3,(H,17,25)
InChIKey BPLWOSKBHBLMDY-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_17635
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: 987/00005884; Labnumber: 987/00005884218872; VK_ID: VK-017640
Temperature 318 °C