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3-methyl-7-(2-oxo-2-phenylethyl)-8-(1-piperidinyl)-3,7-dihydro-1H-purine-2,6-dione

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3-methyl-7-(2-oxo-2-phenylethyl)-8-(1-piperidinyl)-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID CntKlOvkJrM
InChI InChI=1S/C19H21N5O3/c1-22-16-15(17(26)21-19(22)27)24(12-14(25)13-8-4-2-5-9-13)18(20-16)23-10-6-3-7-11-23/h2,4-5,8-9H,3,6-7,10-12H2,1H3,(H,21,26,27)
InChIKey XOQAJENCJUVCDR-UHFFFAOYSA-N
Mol Weight 367.41 g/mol
Molecular Formula C19H21N5O3
Exact Mass 367.16444 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KkznoeKSFEq
Name 3-methyl-7-(2-oxo-2-phenylethyl)-8-(1-piperidinyl)-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/C19H21N5O3/c1-22-16-15(17(26)21-19(22)27)24(12-14(25)13-8-4-2-5-9-13)18(20-16)23-10-6-3-7-11-23/h2,4-5,8-9H,3,6-7,10-12H2,1H3,(H,21,26,27)
InChIKey XOQAJENCJUVCDR-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25259
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: D49603; Labnumber: UZROM-3983; SBI_ID: SBI-025263
Temperature 318 °C