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1-Benzyl-5-(tosy)sulfinyl-1,4-dihydropyridine-3-carbonitrile
SpectraBase Compound ID 2EAmb8j9qRF
InChI InChI=1S/C20H18N2OS/c1-16-7-9-19(10-8-16)24(23)20-11-18(12-21)14-22(15-20)13-17-5-3-2-4-6-17/h2-10,14-15H,11,13H2,1H3
InChIKey DDUZKYXUJUPINT-UHFFFAOYSA-N
Mol Weight 334.44 g/mol
Molecular Formula C20H18N2OS
Exact Mass 334.113984 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C6kM2W1MoT7
Name 1-Benzyl-5-(tosy)sulfinyl-1,4-dihydropyridine-3-carbonitrile
Alternate Name(s) 1-Benzyl-5-(tolyl)sulfinyl-1,4-dihydropyridine-3-carbonitrile 1-Benzyl-5-(4-methylphenyl)sulfinyl-4H-pyridine-3-carbonitrile 5-(4-Methylphenyl)sulfinyl-1-(phenylmethyl)-4H-pyridine-3-carbonitrile
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Formula C20H18N2OS
InChI InChI=1S/C20H18N2OS/c1-16-7-9-19(10-8-16)24(23)20-11-18(12-21)14-22(15-20)13-17-5-3-2-4-6-17/h2-10,14-15H,11,13H2,1H3
InChIKey DDUZKYXUJUPINT-UHFFFAOYSA-N
Molecular Weight 334.437 g/mol
SMILES C1(S(c2ccc(cc2)C)=O)=CN(Cc2ccccc2)C=C(C1)C#N
SPLASH splash10-0a4i-9034000000-5bc951ccee786f0a0f97
Source of Spectrum QE-6-1770-15
Wiley ID 844804