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8-(3,5-dimethyl-1-piperidinyl)-3-methyl-7-[2-(2-pyrimidinylsulfanyl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID 3sGc8Znn4zv
InChI InChI=1S/C19H25N7O2S/c1-12-9-13(2)11-25(10-12)18-22-15-14(16(27)23-19(28)24(15)3)26(18)7-8-29-17-20-5-4-6-21-17/h4-6,12-13H,7-11H2,1-3H3,(H,23,27,28)
InChIKey NTBPNIQOEZBTNP-UHFFFAOYSA-N
Mol Weight 415.52 g/mol
Molecular Formula C19H25N7O2S
Exact Mass 415.179044 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8Famnjmqcs2
Name 8-(3,5-dimethyl-1-piperidinyl)-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/C19H25N7O2S/c1-12-9-13(2)11-25(10-12)18-22-15-14(16(27)23-19(28)24(15)3)26(18)7-8-29-17-20-5-4-6-21-17/h4-6,12-13H,7-11H2,1-3H3,(H,23,27,28)
InChIKey NTBPNIQOEZBTNP-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_22017
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: D58160; Labnumber: UZ01F011-4170; SBI_ID: SBI-022021
Temperature 308 °C