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8-[4-(2-hydroxyethyl)-1-piperazinyl]-3-methyl-7-[2-(2-pyrimidinylsulfanyl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID F0EznZmQzrg
InChI InChI=1S/C18H24N8O3S/c1-23-14-13(15(28)22-18(23)29)26(10-12-30-16-19-3-2-4-20-16)17(21-14)25-7-5-24(6-8-25)9-11-27/h2-4,27H,5-12H2,1H3,(H,22,28,29)
InChIKey ZBZDSMYCYROCDW-UHFFFAOYSA-N
Mol Weight 432.5 g/mol
Molecular Formula C18H24N8O3S
Exact Mass 432.169208 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CRoOhaBooyI
Name 8-[4-(2-hydroxyethyl)-1-piperazinyl]-3-methyl-7-[2-(2-pyrimidinylsulfanyl)ethyl]-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/C18H24N8O3S/c1-23-14-13(15(28)22-18(23)29)26(10-12-30-16-19-3-2-4-20-16)17(21-14)25-7-5-24(6-8-25)9-11-27/h2-4,27H,5-12H2,1H3,(H,22,28,29)
InChIKey ZBZDSMYCYROCDW-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_22026
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: D58171; Labnumber: UZ01F011-4186; SBI_ID: SBI-022030
Temperature 318 °C