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

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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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AlOj3OG0TJA
Name 2-[(1,3-DIMETHYL-4-NITROPYRAZOL-5-YL)THIO]PYRIMIDINE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 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
Melting Point 92-94C
Molecular Weight 251.27
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms PYRIMIDINE, 2-[(1,3-DIMETHYL-4-NITROPYRAZOL-5-YL)THIO]-,