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3-Iodo-2-(4-iodobut-1-ynyl)benzo[b]thiophene
SpectraBase Compound ID 8sbvR8Q8Xnw
InChI InChI=1S/C12H8I2S/c13-8-4-3-7-11-12(14)9-5-1-2-6-10(9)15-11/h1-2,5-6H,4,8H2
InChIKey VPBJZQDWFYCEMU-UHFFFAOYSA-N
Mol Weight 438.06 g/mol
Molecular Formula C12H8I2S
Exact Mass 437.843611 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jf44Khtgbkf
Name 3-Iodo-2-(4-iodobut-1-ynyl)benzo[b]thiophene
Alternate Name(s) 3-Iodo-2-(4-iodobut-1-yn-1-yl)benzo[b]thiophene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8I2S
InChI InChI=1S/C12H8I2S/c13-8-4-3-7-11-12(14)9-5-1-2-6-10(9)15-11/h1-2,5-6H,4,8H2
InChIKey VPBJZQDWFYCEMU-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo501396s
Molecular Weight 438.065 g/mol
SMILES c1cc2c(c(sc2cc1)C#CCCI)I
SPLASH splash10-000i-0500900000-dbc956fead6c966a1d25
Source of Spectrum J-79-9038-10i
Wiley ID 1748122