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thiazolo[2,3-b]pyrimidine-3,5-quinone

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thiazolo[2,3-b]pyrimidine-3,5-quinone
SpectraBase Compound ID Kbp3MqiwH5B
InChI InChI=1S/C6H4N2O2S/c9-4-1-2-7-6-8(4)5(10)3-11-6/h1-2H,3H2
InChIKey QETUGZANTBCBHH-UHFFFAOYSA-N
Mol Weight 168.17 g/mol
Molecular Formula C6H4N2O2S
Exact Mass 167.999349 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7SX15g2cb7e
Name Thiazolo(3,2-A)pyrimidin-5-one
CAS Registry Number 112498-45-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H4N2O2S
InChI InChI=1S/C6H4N2O2S/c9-4-1-2-7-6-8(4)5(10)3-11-6/h1-2H,3H2
InChIKey QETUGZANTBCBHH-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference E. Wyrzykiewicz, J. Wybieralska, Magn. Res. Chem. 25, 550 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6