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2-(benzylthio)-4-(5-chloro-3-methylbenzo[b]thien-2-yl)pyrimidine

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

2-(benzylthio)-4-(5-chloro-3-methylbenzo[b]thien-2-yl)pyrimidine
SpectraBase Compound ID 5MgjQnAuaJ9
InChI InChI=1S/C20H15ClN2S2/c1-13-16-11-15(21)7-8-18(16)25-19(13)17-9-10-22-20(23-17)24-12-14-5-3-2-4-6-14/h2-11H,12H2,1H3
InChIKey AXSQNTLEACAWES-UHFFFAOYSA-N
Mol Weight 382.93 g/mol
Molecular Formula C20H15ClN2S2
Exact Mass 382.036519 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4FCUVL5h07A
Name 2-(BENZYLTHIO)-4-(5-CHLORO-3-METHYLBENZO[b]THIEN-2-YL)PYRIMIDINE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15ClN2S2
InChI InChI=1S/C20H15ClN2S2/c1-13-16-11-15(21)7-8-18(16)25-19(13)17-9-10-22-20(23-17)24-12-14-5-3-2-4-6-14/h2-11H,12H2,1H3
InChIKey AXSQNTLEACAWES-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 137-139C
Molecular Weight 382.94
Solvent CDCl3; Reference=TMS; Temperature 297K