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1,3-dimethyl-8-(4-methyl-1-piperazinyl)-7-{2-[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID 8UYtL63sv9K
InChI InChI=1S/C21H26N10O2S/c1-26-9-11-29(12-10-26)19-22-17-16(18(32)28(3)21(33)27(17)2)30(19)13-14-34-20-23-24-25-31(20)15-7-5-4-6-8-15/h4-8H,9-14H2,1-3H3
InChIKey DJKXQBWOZXQJTP-UHFFFAOYSA-N
Mol Weight 482.57 g/mol
Molecular Formula C21H26N10O2S
Exact Mass 482.196091 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8aMoLu59pik
Name 1,3-dimethyl-8-(4-methyl-1-piperazinyl)-7-{2-[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]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/C21H26N10O2S/c1-26-9-11-29(12-10-26)19-22-17-16(18(32)28(3)21(33)27(17)2)30(19)13-14-34-20-23-24-25-31(20)15-7-5-4-6-8-15/h4-8H,9-14H2,1-3H3
InChIKey DJKXQBWOZXQJTP-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_22064
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: D58216; Labnumber: UZ01F011-4261; SBI_ID: SBI-022068
Temperature 318 °C