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5-Bromo-2-(4-fluorophenyl)-3-[4-(N-cyanomethylsulfonimidoyl)phenyl]thiophene
SpectraBase Compound ID LD68oojoT1L
InChI InChI=1S/C18H12BrFN2OS2/c1-25(23,22-11-21)15-8-4-12(5-9-15)16-10-17(19)24-18(16)13-2-6-14(20)7-3-13/h2-10H,1H3
InChIKey CTSLLLKLGQJNHL-UHFFFAOYSA-N
Mol Weight 435.33 g/mol
Molecular Formula C18H12BrFN2OS2
Exact Mass 433.955847 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EnzxhiyqJg2
Name 5-Bromo-2-(4-fluorophenyl)-3-[4-(N-cyanomethylsulfonimidoyl)phenyl]thiophene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12BrFN2OS2
InChI InChI=1S/C18H12BrFN2OS2/c1-25(23,22-11-21)15-8-4-12(5-9-15)16-10-17(19)24-18(16)13-2-6-14(20)7-3-13/h2-10H,1H3
InChIKey CTSLLLKLGQJNHL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cmdc.201200403
Molecular Weight 435.329 g/mol
SMILES c1(ccc(cc1)F)-c1c(cc(s1)Br)-c1ccc(cc1)S(=O)(=NC#N)C
SPLASH splash10-003i-0013900000-80380afd5ce19fd0260b
Source of Spectrum CMC-8-217/SM7-6
Wiley ID 1772906