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1-[2-[(4-bromobenzyl)thio]ethyl]-4-phenyl-imidazole
SpectraBase Compound ID JnWwvAwhQSs
InChI InChI=1S/C18H17BrN2S/c19-17-8-6-15(7-9-17)13-22-11-10-21-12-18(20-14-21)16-4-2-1-3-5-16/h1-9,12,14H,10-11,13H2
InChIKey ZQLVRSAUZYQIIZ-UHFFFAOYSA-N
Mol Weight 373.31 g/mol
Molecular Formula C18H17BrN2S
Exact Mass 372.029583 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EUJzg2528ne
Name 1-[2-[(4-bromobenzyl)thio]ethyl]-4-phenyl-imidazole
CAS Registry Number 66718-53-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17BrN2S
InChI InChI=1S/C18H17BrN2S/c19-17-8-6-15(7-9-17)13-22-11-10-21-12-18(20-14-21)16-4-2-1-3-5-16/h1-9,12,14H,10-11,13H2
InChIKey ZQLVRSAUZYQIIZ-UHFFFAOYSA-N
Molecular Weight 373.312 g/mol
SMILES c1(nc[n](c1)CCSCc1ccc(cc1)Br)-c1ccccc1
SPLASH splash10-00di-0957000000-cedfa4dea69967582838
Source of Spectrum Y-15-309-0
Synonyms 1-[2-[(4-bromophenyl)methylsulfanyl]ethyl]-4-phenyl-imidazole 1-[2-[(4-bromophenyl)methylthio]ethyl]-4-phenylimidazole
Wiley ID 1355293