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5'-Bromo-4'-dodecyl-3-phenyl-[2,2']-thiophene
SpectraBase Compound ID 9zYPfH8Jb6S
InChI InChI=1S/C26H33BrS2/c1-2-3-4-5-6-7-8-9-10-12-17-22-20-24(29-26(22)27)25-23(18-19-28-25)21-15-13-11-14-16-21/h11,13-16,18-20H,2-10,12,17H2,1H3
InChIKey MTSVJGYHCLKJIV-UHFFFAOYSA-N
Mol Weight 489.6 g/mol
Molecular Formula C26H33BrS2
Exact Mass 488.120706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4PFLYdIzjDf
Name 5'-Bromo-4'-dodecyl-3-phenyl-[2,2']-thiophene
Alternate Name(s) 2-Bromo-3-dodecyl-5-(3-phenyl-2-thiophenyl)thiophene 2-Bromo-3-dodecyl-5-(3-phenylthiophen-2-yl)thiophene 2-Bromo-3-dodecyl-5-(3-phenyl-2-thienyl)thiophene 2-Bromanyl-3-dodecyl-5-(3-phenylthiophen-2-yl)thiophene
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Formula C26H33BrS2
InChI InChI=1S/C26H33BrS2/c1-2-3-4-5-6-7-8-9-10-12-17-22-20-24(29-26(22)27)25-23(18-19-28-25)21-15-13-11-14-16-21/h11,13-16,18-20H,2-10,12,17H2,1H3
InChIKey MTSVJGYHCLKJIV-UHFFFAOYSA-N
Molecular Weight 489.574 g/mol
SMILES c1(-c2c(ccs2)-c2ccccc2)sc(Br)c(c1)CCCCCCCCCCCC
SPLASH splash10-0a4i-0090600000-5145aeb9aae24c261ec9
Source of Spectrum K1-2001-3442-7
Wiley ID 814378