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

*Links on SpectraBase are not permalinks.

4,7-DIHYDRO-2-MERCAPTO-3H-PYRROLO[2,3-d]PYRIMIDIN-4-ONE

View entire compound with spectra: 2 NMR

4,7-DIHYDRO-2-MERCAPTO-3H-PYRROLO[2,3-d]PYRIMIDIN-4-ONE
SpectraBase Compound ID BoEt6Cm76HR
InChI InChI=1S/C6H5N3OS/c10-5-3-1-2-7-4(3)8-6(11)9-5/h1-2H,(H3,7,8,9,10,11)
InChIKey QCZHCRBHXAFBDJ-UHFFFAOYSA-N
Mol Weight 167.19 g/mol
Molecular Formula C6H5N3OS
Exact Mass 167.015333 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7IqReZqUz8a
Name 4,7-DIHYDRO-2-MERCAPTO-3H-PYRROLO[2,3-d]PYRIMIDIN-4-ONE
Source of Sample F. Seela, R. Richter Chem. Ber. 111, 2925(1978)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H5N3OS
InChI InChI=1S/C6H5N3OS/c10-5-3-1-2-7-4(3)8-6(11)9-5/h1-2H,(H3,7,8,9,10,11)
InChIKey QCZHCRBHXAFBDJ-UHFFFAOYSA-N
Molecular Weight 167.19
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WH-270
Synonyms 3H-PYRROLO/2,3-D/PYRIMIDIN-4-ONE, 4,7-DIHYDRO-2-MERCAPTO-,