For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

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

View entire compound with spectra: 1 NMR

7-(3-bromobenzyl)-3-methyl-8-(propylamino)-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID Iey1XiDkyRk
InChI InChI=1S/C16H18BrN5O2/c1-3-7-18-15-19-13-12(14(23)20-16(24)21(13)2)22(15)9-10-5-4-6-11(17)8-10/h4-6,8H,3,7,9H2,1-2H3,(H,18,19)(H,20,23,24)
InChIKey CKOMTIXKMWULCV-UHFFFAOYSA-N
Mol Weight 392.26 g/mol
Molecular Formula C16H18BrN5O2
Exact Mass 391.064388 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8RhStvl3bxC
Name 7-(3-bromobenzyl)-3-methyl-8-(propylamino)-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/C16H18BrN5O2/c1-3-7-18-15-19-13-12(14(23)20-16(24)21(13)2)22(15)9-10-5-4-6-11(17)8-10/h4-6,8H,3,7,9H2,1-2H3,(H,18,19)(H,20,23,24)
InChIKey CKOMTIXKMWULCV-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_8953
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: D40071; Labnumber: UZROM-3768; SBI_ID: SBI-008956
Temperature 308 °C