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7-(4-bromophenyl)-8-(2-hydroxyethyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
SpectraBase Compound ID DPnMjEvIRqG
InChI InChI=1S/C17H16BrN5O3/c1-20-14-13(15(25)21(2)17(20)26)23-9-12(10-3-5-11(18)6-4-10)22(7-8-24)16(23)19-14/h3-6,9,24H,7-8H2,1-2H3
InChIKey VTAWQLIMGNAUDC-UHFFFAOYSA-N
Mol Weight 418.25 g/mol
Molecular Formula C17H16BrN5O3
Exact Mass 417.043652 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FhW88HRRpWW
Name 1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, 7-(4-bromophenyl)-8-(2-hydroxyethyl)-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 417.043652392 u
Formula C17H16BrN5O3
InChI InChI=1S/C17H16BrN5O3/c1-20-14-13(15(25)21(2)17(20)26)23-9-12(10-3-5-11(18)6-4-10)22(7-8-24)16(23)19-14/h3-6,9,24H,7-8H2,1-2H3
InChIKey VTAWQLIMGNAUDC-UHFFFAOYSA-N
Molecular Weight 418.251 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13693
Solvent DMSO-d6
Source Vendor ID: NMR/10301799; Lab Info: POV; Lab Number: POV-0800200