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N,N-Dimethyl-4-((4-(thien-3-yl)pyridin-3-yl)ethynyl)aniline
SpectraBase Compound ID A1hHsqU26Pb
InChI InChI=1S/C19H16N2S/c1-21(2)18-7-4-15(5-8-18)3-6-16-13-20-11-9-19(16)17-10-12-22-14-17/h4-5,7-14H,1-2H3
InChIKey NEZFUABIBQNIID-UHFFFAOYSA-N
Mol Weight 304.41 g/mol
Molecular Formula C19H16N2S
Exact Mass 304.10342 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C0ovR4elNWr
Name N,N-Dimethyl-4-((4-(thien-3-yl)pyridin-3-yl)ethynyl)aniline
Appearance Yellow solid
Carrier Gas Helium
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Exact Mass 304.103419697 u
Formula C19H16N2S
InChI InChI=1S/C19H16N2S/c1-21(2)18-7-4-15(5-8-18)3-6-16-13-20-11-9-19(16)17-10-12-22-14-17/h4-5,7-14H,1-2H3
InChIKey NEZFUABIBQNIID-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95-XP
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202101306
Molecular Weight 304.411 g/mol
Quality 105
Reported Formula C19H16N2S
SMILES CN(C1=CC=C(C=C1)C#CC=1C=NC=CC1C1=CSC=C1)C
SPLASH splash10-0udi-0029000000-52bfcb34372da19777e5
Source of Spectrum K1-2022-SM14-2k (DOI: 10.1002/ejoc.202101306)
Thin-Layer Chromatography 0.25 (Heptane/EtOAc, 3:1)
Wiley ID 1899022