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1,1'-Dimethoxy-9-bromo[7]helicene
SpectraBase Compound ID EMMkS5U4Rpo
InChI InChI=1S/C32H21BrO2/c1-34-29-7-3-5-18-13-20-9-10-22-15-28(33)23-12-11-21-14-19-6-4-8-30(35-2)25(19)17-27(21)32(23)31(22)26(20)16-24(18)29/h3-17H,1-2H3
InChIKey AYICJIMULAHYPN-UHFFFAOYSA-N
Mol Weight 517.4 g/mol
Molecular Formula C32H21BrO2
Exact Mass 516.072493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hz0gfnS8zQ6
Name 1,1'-Dimethoxy-9-bromo[7]helicene
Alternate Name(s) 3-bromo-11,14-dimethoxybenzo[6,7]phenanthro[4,3-a]anthracene
Comments Less than 3 mono-isotopic peaks
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Formula C32H21BrO2
InChI InChI=1S/C32H21BrO2/c1-34-29-7-3-5-18-13-20-9-10-22-15-28(33)23-12-11-21-14-19-6-4-8-30(35-2)25(19)17-27(21)32(23)31(22)26(20)16-24(18)29/h3-17H,1-2H3
InChIKey AYICJIMULAHYPN-UHFFFAOYSA-N
Molecular Weight 517.422 g/mol
SMILES c12c3c4cc5c(OC)cccc5cc4ccc3c(cc1ccc1c2cc2c(OC)cccc2c1)Br
SPLASH splash10-000i-0000900000-763cb94ee277f085151d
Source of Spectrum J-56-3774-9
Wiley ID 1401464