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7-(3-bromobenzyl)-8-(ethylamino)-3-methyl-3,7-dihydro-1H-purine-2,6-dione

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7-(3-bromobenzyl)-8-(ethylamino)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID K8khgnQGA97
InChI InChI=1S/C15H16BrN5O2/c1-3-17-14-18-12-11(13(22)19-15(23)20(12)2)21(14)8-9-5-4-6-10(16)7-9/h4-7H,3,8H2,1-2H3,(H,17,18)(H,19,22,23)
InChIKey YYLHQWROSYFEQT-UHFFFAOYSA-N
Mol Weight 378.23 g/mol
Molecular Formula C15H16BrN5O2
Exact Mass 377.048738 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7MfQ2NrynKz
Name 7-(3-bromobenzyl)-8-(ethylamino)-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/C15H16BrN5O2/c1-3-17-14-18-12-11(13(22)19-15(23)20(12)2)21(14)8-9-5-4-6-10(16)7-9/h4-7H,3,8H2,1-2H3,(H,17,18)(H,19,22,23)
InChIKey YYLHQWROSYFEQT-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_22686
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: D35344; Labnumber: UZROM-3766; SBI_ID: SBI-022690
Temperature 306 °C