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1H-purine-2,6-dione, 7-[2-(4-bromophenyl)-2-oxoethyl]-8-(diethylamino)-3,7-dihydro-1,3-dimethyl-
SpectraBase Compound ID HMnjIqpuBxh
InChI InChI=1S/C19H22BrN5O3/c1-5-24(6-2)18-21-16-15(17(27)23(4)19(28)22(16)3)25(18)11-14(26)12-7-9-13(20)10-8-12/h7-10H,5-6,11H2,1-4H3
InChIKey VXVSZPSLVXDEPL-UHFFFAOYSA-N
Mol Weight 448.32 g/mol
Molecular Formula C19H22BrN5O3
Exact Mass 447.090603 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4u1zzW7DUr8
Name 1H-purine-2,6-dione, 7-[2-(4-bromophenyl)-2-oxoethyl]-8-(diethylamino)-3,7-dihydro-1,3-dimethyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 447.090602585 u
Formula C19H22BrN5O3
InChI InChI=1S/C19H22BrN5O3/c1-5-24(6-2)18-21-16-15(17(27)23(4)19(28)22(16)3)25(18)11-14(26)12-7-9-13(20)10-8-12/h7-10H,5-6,11H2,1-4H3
InChIKey VXVSZPSLVXDEPL-UHFFFAOYSA-N
Molecular Weight 448.321 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13692
Solvent DMSO-d6
Source Vendor ID: NMR/10301795; Lab Info: POV; Lab Number: POV-0800196