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2,5-di(o-tolyl)thiophene
SpectraBase Compound ID HH5BdhR00OU
InChI InChI=1S/C18H16S/c1-13-7-3-5-9-15(13)17-11-12-18(19-17)16-10-6-4-8-14(16)2/h3-12H,1-2H3
InChIKey BWUZPHJRHYHGKD-UHFFFAOYSA-N
Mol Weight 264.39 g/mol
Molecular Formula C18H16S
Exact Mass 264.097272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3akZ6cN09UY
Name 2,5-di(o-tolyl)thiophene
Appearance Colorless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16S
InChI InChI=1S/C18H16S/c1-13-7-3-5-9-15(13)17-11-12-18(19-17)16-10-6-4-8-14(16)2/h3-12H,1-2H3
InChIKey BWUZPHJRHYHGKD-UHFFFAOYSA-N
Instrument Name Finnigan MAT 8200/Shimadzu GC-2010/QP2010
Ionization Type EI+
Literature Reference DOI 10.3762/bjoc.7.174
Molecular Weight 264.386 g/mol
SMILES c1(c(cccc1)C)-c1sc(cc1)-c1ccccc1C
SPLASH splash10-0292-0970000000-6c4b1844dd5d729b85d9
Source of Spectrum BJO-7-SM8-2b
Thin-Layer Chromatography Rf = 0.36 (n-hexane)
Wiley ID 1867142