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5-Cyanimino-4,5-dihydro-3-(4'-chlorophenyl)-4-phenyl-1,2,4-thiadiazole
SpectraBase Compound ID K333iqhlAZ0
InChI InChI=1S/C15H9ClN4S/c16-12-8-6-11(7-9-12)14-19-21-15(18-10-17)20(14)13-4-2-1-3-5-13/h1-9H/b18-15+
InChIKey QXESHGZVXKWOOZ-OBGWFSINSA-N
Mol Weight 312.78 g/mol
Molecular Formula C15H9ClN4S
Exact Mass 312.023645 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LqoiLkJsRBw
Name 5-Cyanimino-4,5-dihydro-3-(4'-chlorophenyl)-4-phenyl-1,2,4-thiadiazole
Alternate Name(s) (5E)-3-(4-chlorophenyl)-4-phenyl-1,2,4-thiadiazol-5(4H)-ylidenecyanamide
CAS Registry Number 138572-14-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H9ClN4S
InChI InChI=1S/C15H9ClN4S/c16-12-8-6-11(7-9-12)14-19-21-15(18-10-17)20(14)13-4-2-1-3-5-13/h1-9H/b18-15+
InChIKey QXESHGZVXKWOOZ-OBGWFSINSA-N
Molecular Weight 312.778 g/mol
SMILES C=1(N(\C(SN1)=N/C#N)c1ccccc1)c1ccc(cc1)Cl
SPLASH splash10-0400-2906000000-78647e0c2d10f22e8e2b
Source of Spectrum U-1992-288-5
Wiley ID 764042