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Pyrrolo(2,3-D)pyrimidin-4-one
SpectraBase Compound ID DPxESAneb1o
InChI InChI=1S/C6H5N3O/c10-6-4-1-2-7-5(4)8-3-9-6/h1-3H,(H2,7,8,9,10)
InChIKey FBMZEITWVNHWJW-UHFFFAOYSA-N
Mol Weight 135.13 g/mol
Molecular Formula C6H5N3O
Exact Mass 135.043262 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 71v3TIINCs6
Name Pyrrolo(2,3-D)pyrimidin-4-one
CAS Registry Number 3680-71-5
Comments 0.89 MOLAR
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H5N3O
InChI InChI=1S/C6H5N3O/c10-6-4-1-2-7-5(4)8-3-9-6/h1-3H,(H2,7,8,9,10)
InChIKey FBMZEITWVNHWJW-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference M.T. Chenon, R.J. Pugmire, D.M.Grant, J. Am. Chem. Soc. 97, 4627 (1975).
NMR Standard DMSO
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO