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2-(benzylthio)-4-(3-pyridyl)pyrimidine

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2-(benzylthio)-4-(3-pyridyl)pyrimidine
SpectraBase Compound ID DW8VDlh05hl
InChI InChI=1S/C16H13N3S/c1-2-5-13(6-3-1)12-20-16-18-10-8-15(19-16)14-7-4-9-17-11-14/h1-11H,12H2
InChIKey NOZRCUKFDFICMG-UHFFFAOYSA-N
Mol Weight 279.36 g/mol
Molecular Formula C16H13N3S
Exact Mass 279.083019 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HIvrCmvSUPY
Name 2-(BENZYLTHIO)-4-(3-PYRIDYL)PYRIMIDINE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13N3S
InChI InChI=1S/C16H13N3S/c1-2-5-13(6-3-1)12-20-16-18-10-8-15(19-16)14-7-4-9-17-11-14/h1-11H,12H2
InChIKey NOZRCUKFDFICMG-UHFFFAOYSA-N
Melting Point 63-65C
Molecular Weight 279.37
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms PYRIMIDINE, 2-(BENZYLTHIO)-4-(3-PYRIDYL)-,