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8-[4-(3-chlorophenyl)-1-piperazinyl]-7-(2-methoxyethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID ATEUDSUFhkA
InChI InChI=1S/C19H23ClN6O3/c1-23-16-15(17(27)22-19(23)28)26(10-11-29-2)18(21-16)25-8-6-24(7-9-25)14-5-3-4-13(20)12-14/h3-5,12H,6-11H2,1-2H3,(H,22,27,28)
InChIKey QUBFOSOEEBCFQX-UHFFFAOYSA-N
Mol Weight 418.89 g/mol
Molecular Formula C19H23ClN6O3
Exact Mass 418.152016 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1wUarTpQh6S
Name 8-[4-(3-chlorophenyl)-1-piperazinyl]-7-(2-methoxyethyl)-3-methyl-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/C19H23ClN6O3/c1-23-16-15(17(27)22-19(23)28)26(10-11-29-2)18(21-16)25-8-6-24(7-9-25)14-5-3-4-13(20)12-14/h3-5,12H,6-11H2,1-2H3,(H,22,27,28)
InChIKey QUBFOSOEEBCFQX-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_7633
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: D31332; Labnumber: UZ01F011-2582; SBI_ID: SBI-007636
Temperature 318 °C