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2-[(1,3-dimethyl-4-nitropyrazol-5-yl)thio]pyrimidine

View entire compound with spectra: 3 NMR, and 1 FTIR

2-[(1,3-dimethyl-4-nitropyrazol-5-yl)thio]pyrimidine
SpectraBase Compound ID F8F07BgaWSw
InChI InChI=1S/C9H9N5O2S/c1-6-7(14(15)16)8(13(2)12-6)17-9-10-4-3-5-11-9/h3-5H,1-2H3
InChIKey YKPXODHFHZBSBT-UHFFFAOYSA-N
Mol Weight 251.26 g/mol
Molecular Formula C9H9N5O2S
Exact Mass 251.047696 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 74V64knizgA
Name 2-[(1,3-DIMETHYL-4-NITROPYRAZOL-5-YL)THIO]PYRIMIDINE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9N5O2S
InChI InChI=1S/C9H9N5O2S/c1-6-7(14(15)16)8(13(2)12-6)17-9-10-4-3-5-11-9/h3-5H,1-2H3
InChIKey YKPXODHFHZBSBT-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 92-94C
Molecular Weight 251.27
Solvent CDCl3; Reference=TMS; Temperature 297K