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5-(p-chlorobenzylidene)-4-(p-chlorophenyl)-6,7-dihydro-2-(methylthio)-5H-cyclopentapyrimidine

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5-(p-chlorobenzylidene)-4-(p-chlorophenyl)-6,7-dihydro-2-(methylthio)-5H-cyclopentapyrimidine
SpectraBase Compound ID 9L0OkzjOLZb
InChI InChI=1S/C21H16Cl2N2S/c1-26-21-24-18-11-6-15(12-13-2-7-16(22)8-3-13)19(18)20(25-21)14-4-9-17(23)10-5-14/h2-5,7-10,12H,6,11H2,1H3
InChIKey NRCMPRXLUGYZFY-UHFFFAOYSA-N
Mol Weight 399.34 g/mol
Molecular Formula C21H16Cl2N2S
Exact Mass 398.041125 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3h5htwALNnf
Name 5-(p-CHLOROBENZYLIDENE)-4-(p-CHLOROPHENYL)-6,7-DIHYDRO-2-(METHYLTHIO)-5H-CYCLOPENTAPYRIMIDINE
Source of Sample G.H. Elgemeie & S.S. Al-Kaabi, Qatar University, State of Qatar
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16Cl2N2S
InChI InChI=1S/C21H16Cl2N2S/c1-26-21-24-18-11-6-15(12-13-2-7-16(22)8-3-13)19(18)20(25-21)14-4-9-17(23)10-5-14/h2-5,7-10,12H,6,11H2,1H3
InChIKey NRCMPRXLUGYZFY-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 155C
Molecular Weight 399.35
Solvent CDCl3; Reference=TMS; Temperature 297K