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4-(4-Isopropyl-phenyl)-6-(5,6,7,8-tetrahydronaphthalen-2-yl)-2-thioxo-1,2-dihydro-pyridine-3-carbonitrile
SpectraBase Compound ID KcmzbdX6JDR
InChI InChI=1S/C25H24N2S/c1-16(2)17-7-10-19(11-8-17)22-14-24(27-25(28)23(22)15-26)21-12-9-18-5-3-4-6-20(18)13-21/h7-14,16H,3-6H2,1-2H3,(H,27,28)
InChIKey XUDUABPWLBDVGV-UHFFFAOYSA-N
Mol Weight 384.54 g/mol
Molecular Formula C25H24N2S
Exact Mass 384.16602 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BdRFa7Rp5hN
Name 4-(4-Isopropyl-phenyl)-6-(5,6,7,8-tetrahydronaphthalen-2-yl)-2-thioxo-1,2-dihydro-pyridine-3-carbonitrile
Alternate Name(s) 4-(4-isopropylphenyl)-6-tetralin-6-yl-2-thioxo-1H-pyridine-3-carbonitrile 4-(4-propan-2-ylphenyl)-2-sulfanylidene-6-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyridine-3-carbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C25H24N2S
InChI InChI=1S/C25H24N2S/c1-16(2)17-7-10-19(11-8-17)22-14-24(27-25(28)23(22)15-26)21-12-9-18-5-3-4-6-20(18)13-21/h7-14,16H,3-6H2,1-2H3,(H,27,28)
InChIKey XUDUABPWLBDVGV-UHFFFAOYSA-N
Molecular Weight 384.541 g/mol
SMILES N1C(C(=C(C=C1c1cc2CCCCc2cc1)c1ccc(cc1)C(C)C)C#N)=S
SPLASH splash10-001i-0009000000-99e723af886245e95f77
Source of Spectrum F2-44-4553-3b
Wiley ID 1705801