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8-(4-benzyl-1-piperidinyl)-3-methyl-7-[2-(2-pyrimidinylsulfanyl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID Fk8aAKfDin9
InChI InChI=1S/C24H27N7O2S/c1-29-20-19(21(32)28-24(29)33)31(14-15-34-22-25-10-5-11-26-22)23(27-20)30-12-8-18(9-13-30)16-17-6-3-2-4-7-17/h2-7,10-11,18H,8-9,12-16H2,1H3,(H,28,32,33)
InChIKey LZTWHYADIJIMIT-UHFFFAOYSA-N
Mol Weight 477.59 g/mol
Molecular Formula C24H27N7O2S
Exact Mass 477.194694 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ddm5M0j2A2c
Name 8-(4-benzyl-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/C24H27N7O2S/c1-29-20-19(21(32)28-24(29)33)31(14-15-34-22-25-10-5-11-26-22)23(27-20)30-12-8-18(9-13-30)16-17-6-3-2-4-7-17/h2-7,10-11,18H,8-9,12-16H2,1H3,(H,28,32,33)
InChIKey LZTWHYADIJIMIT-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_22015
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: D58158; Labnumber: UZ01F011-4168; SBI_ID: SBI-022019
Temperature 308 °C