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

*Links on SpectraBase are not permalinks.
1H-purine-2,6-dione, 7-[3-(2,4-dichlorophenoxy)-2-hydroxypropyl]-8-(dimethylamino)-3,7-dihydro-3-methyl-
SpectraBase Compound ID 5fKq0ClzB9Y
InChI InChI=1S/C17H19Cl2N5O4/c1-22(2)16-20-14-13(15(26)21-17(27)23(14)3)24(16)7-10(25)8-28-12-5-4-9(18)6-11(12)19/h4-6,10,25H,7-8H2,1-3H3,(H,21,26,27)
InChIKey RTTGXAQBAYCWGI-UHFFFAOYSA-N
Mol Weight 428.28 g/mol
Molecular Formula C17H19Cl2N5O4
Exact Mass 427.08141 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 CnXfdPz10Mc
Name 1H-purine-2,6-dione, 7-[3-(2,4-dichlorophenoxy)-2-hydroxypropyl]-8-(dimethylamino)-3,7-dihydro-3-methyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 427.081409508 u
Formula C17H19Cl2N5O4
InChI InChI=1S/C17H19Cl2N5O4/c1-22(2)16-20-14-13(15(26)21-17(27)23(14)3)24(16)7-10(25)8-28-12-5-4-9(18)6-11(12)19/h4-6,10,25H,7-8H2,1-3H3,(H,21,26,27)
InChIKey RTTGXAQBAYCWGI-UHFFFAOYSA-N
Molecular Weight 428.276 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_3076
Solvent DMSO-d6
Source Vendor ID: NMR/9258452; Lab Info: *0390276*; Lab Number: BAS 0390276
Temperature 29.85 °C