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2,2'-Bis(4-(4-methylphenyl)-4,5-dihydro-5-imino-1,3,4-thiadiazole)
SpectraBase Compound ID J9PiCr9Bz0u
InChI InChI=1S/C18H16N6S2/c1-11-3-7-13(8-4-11)23-17(19)25-15(21-23)16-22-24(18(20)26-16)14-9-5-12(2)6-10-14/h3-10,19-20H,1-2H3
InChIKey DBPCMVMTPFTNAG-UHFFFAOYSA-N
Mol Weight 380.49 g/mol
Molecular Formula C18H16N6S2
Exact Mass 380.087787 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8SL8O9OB2HU
Name 2,2'-Bis(4-(4-methylphenyl)-4,5-dihydro-5-imino-1,3,4-thiadiazole)
Alternate Name(s) 5-[5-imino-4-(4-methylphenyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]-3-(4-methylphenyl)-2,3-dihydro-1,3,4-thiadiazol-2-imine
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Formula C18H16N6S2
InChI InChI=1S/C18H16N6S2/c1-11-3-7-13(8-4-11)23-17(19)25-15(21-23)16-22-24(18(20)26-16)14-9-5-12(2)6-10-14/h3-10,19-20H,1-2H3
InChIKey DBPCMVMTPFTNAG-UHFFFAOYSA-N
Molecular Weight 380.488 g/mol
SMILES N=C1N(N=C(C=2SC(N(N2)c2ccc(cc2)C)=N)S1)c1ccc(cc1)C
SPLASH splash10-0a4i-2902000000-03a68a92276b4a3ab270
Source of Spectrum F-50-5095-5
Wiley ID 1359557