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[2-(dimethylamino)phenyl]-(2-thienyl)methanone
SpectraBase Compound ID 5BSpcB3enL6
InChI InChI=1S/C13H13NOS/c1-14(2)11-7-4-3-6-10(11)13(15)12-8-5-9-16-12/h3-9H,1-2H3
InChIKey FTTAEUNWVLIUJE-UHFFFAOYSA-N
Mol Weight 231.31 g/mol
Molecular Formula C13H13NOS
Exact Mass 231.071785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID XkNR1gspO9
Name [2-(dimethylamino)phenyl]-(2-thienyl)methanone
Appearance Yellow oil
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Formula C13H13NOS
InChI InChI=1S/C13H13NOS/c1-14(2)11-7-4-3-6-10(11)13(15)12-8-5-9-16-12/h3-9H,1-2H3
InChIKey FTTAEUNWVLIUJE-UHFFFAOYSA-N
Instrument Name HP 6890-MSD 5973
Ionization Type EI
Literature Reference DOI 10.1002/anie.202016422
Molecular Weight 231.313 g/mol
Reported Formula C13H13NOS
SMILES c1c(c(ccc1)C(=O)c1sccc1)N(C)C
SPLASH splash10-01ot-0960000000-0ca656cacf9f4b541e3f
Source of Spectrum ACI-60-SM55-4b
Thin-Layer Chromatography Rf = 0.17 (isohexane/ethyl acetate, 96:4)
Wiley ID 1880235