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(1,1-Diethyl-2-iodo-1H-inden-3-yl) (p-tolyl) sulfide
SpectraBase Compound ID 5jtcb2cVeHP
InChI InChI=1S/C20H21IS/c1-4-20(5-2)17-9-7-6-8-16(17)18(19(20)21)22-15-12-10-14(3)11-13-15/h6-13H,4-5H2,1-3H3
InChIKey VNDCJUIDAWWYAG-UHFFFAOYSA-N
Mol Weight 420.35 g/mol
Molecular Formula C20H21IS
Exact Mass 420.040867 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5tuGXHDYOZ3
Name (1,1-Diethyl-2-iodo-1H-inden-3-yl) (p-tolyl) sulfide
Appearance Colourless oil
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Formula C20H21IS
InChI InChI=1S/C20H21IS/c1-4-20(5-2)17-9-7-6-8-16(17)18(19(20)21)22-15-12-10-14(3)11-13-15/h6-13H,4-5H2,1-3H3
InChIKey VNDCJUIDAWWYAG-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202200613
Molecular Weight 420.352 g/mol
Reported Formula C20H22IS
SMILES c12ccccc2C(C(=C1Sc1ccc(cc1)C)I)(CC)CC
SPLASH splash10-00do-0590300000-8e6455d19e57deb5da1b
Source of Spectrum ASC-364-SM22-2l
Thin-Layer Chromatography Rf = 0.32 (Hexane)
Wiley ID 1872945