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1H-purine-7-acetic acid, 2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-, 2-[(E)-(5-bromo-2-fluorophenyl)methylidene]hydrazide

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1H-purine-7-acetic acid, 2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-, 2-[(E)-(5-bromo-2-fluorophenyl)methylidene]hydrazide
SpectraBase Compound ID 7oTYOf7XurU
InChI InChI=1S/C16H14BrFN6O3/c1-22-14-13(15(26)23(2)16(22)27)24(8-19-14)7-12(25)21-20-6-9-5-10(17)3-4-11(9)18/h3-6,8H,7H2,1-2H3,(H,21,25)/b20-6+
InChIKey JOAQEYDEWQGRJF-CGOBSMCZSA-N
Mol Weight 437.23 g/mol
Molecular Formula C16H14BrFN6O3
Exact Mass 436.029479 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6C9Y3nJqAnm
Name 1H-purine-7-acetic acid, 2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-, 2-[(E)-(5-bromo-2-fluorophenyl)methylidene]hydrazide
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/C16H14BrFN6O3/c1-22-14-13(15(26)23(2)16(22)27)24(8-19-14)7-12(25)21-20-6-9-5-10(17)3-4-11(9)18/h3-6,8H,7H2,1-2H3,(H,21,25)/b20-6+
InChIKey JOAQEYDEWQGRJF-CGOBSMCZSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5042
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: NMR/10248724