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

*Links on SpectraBase are not permalinks.

7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-8-(1-pyrrolidinyl)-3,7-dihydro-1H-purine-2,6-dione

View entire compound with spectra: 1 NMR

7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-8-(1-pyrrolidinyl)-3,7-dihydro-1H-purine-2,6-dione
SpectraBase Compound ID Kjvr4Tv8HoD
InChI InChI=1S/C18H19ClFN5O2/c1-22-15-14(16(26)23(2)18(22)27)25(17(21-15)24-8-3-4-9-24)10-11-12(19)6-5-7-13(11)20/h5-7H,3-4,8-10H2,1-2H3
InChIKey IENWAGAKLQBJFD-UHFFFAOYSA-N
Mol Weight 391.83 g/mol
Molecular Formula C18H19ClFN5O2
Exact Mass 391.121131 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 FQrZa8LPJ6k
Name 7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-8-(1-pyrrolidinyl)-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/C18H19ClFN5O2/c1-22-15-14(16(26)23(2)18(22)27)25(17(21-15)24-8-3-4-9-24)10-11-12(19)6-5-7-13(11)20/h5-7H,3-4,8-10H2,1-2H3
InChIKey IENWAGAKLQBJFD-UHFFFAOYSA-N
NMR Offset 15.3512
NMR Spectrometer Frequency 300.133
Observed nucleus 1H
Origin 1H_SBI_36227_8746
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent CDCl3
Source File Reference VendorID: D36361; Labnumber: LRP02-0922; SBI_ID: SBI-008749
Temperature 318 °C