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(1-benzyl-5-methyl-2-methylsulfanyl-pyrrol-3-yl)-(p-tolyl)methanone
SpectraBase Compound ID CEuUO1qYFjY
InChI InChI=1S/C21H21NOS/c1-15-9-11-18(12-10-15)20(23)19-13-16(2)22(21(19)24-3)14-17-7-5-4-6-8-17/h4-13H,14H2,1-3H3
InChIKey FQDGTCVODJABBW-UHFFFAOYSA-N
Mol Weight 335.47 g/mol
Molecular Formula C21H21NOS
Exact Mass 335.134385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EWj926nWGH4
Name (1-benzyl-5-methyl-2-methylsulfanyl-pyrrol-3-yl)-(p-tolyl)methanone
Comments Less than 3 mono-isotopic peaks
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Formula C21H21NOS
InChI InChI=1S/C21H21NOS/c1-15-9-11-18(12-10-15)20(23)19-13-16(2)22(21(19)24-3)14-17-7-5-4-6-8-17/h4-13H,14H2,1-3H3
InChIKey FQDGTCVODJABBW-UHFFFAOYSA-N
Molecular Weight 335.465 g/mol
SMILES c1(c([n](Cc2ccccc2)c(c1)C)SC)C(c1ccc(cc1)C)=O
SPLASH splash10-000i-0009000000-48a0d6e2b085e2641d60
Source of Spectrum KC-0-1726-11
Synonyms (1-benzyl-5-methyl-2-methylsulfanylpyrrol-3-yl)-(4-methylphenyl)methanone [1-benzyl-5-methyl-2-(methylthio)pyrrol-3-yl]-(p-tolyl)methanone [5-methyl-2-(methylthio)-1-(phenylmethyl)-3-pyrrolyl]-(4-methylphenyl)methanone [5-methyl-2-methylsulfanyl-1-(phenylmethyl)pyrrol-3-yl]-(4-methylphenyl)methanone
Wiley ID 784065