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4-(2-Bromo-4,5-dimethoxyphenyl)-5-(2-bromophenyl)isoxazole

View entire compound with spectra: 1 MS (GC)

4-(2-Bromo-4,5-dimethoxyphenyl)-5-(2-bromophenyl)isoxazole
SpectraBase Compound ID 1eYkIblS9Lf
InChI InChI=1S/C17H13Br2NO3/c1-21-15-7-11(14(19)8-16(15)22-2)12-9-20-23-17(12)10-5-3-4-6-13(10)18/h3-9H,1-2H3
InChIKey APOAPNBXXIDUTK-UHFFFAOYSA-N
Mol Weight 439.1 g/mol
Molecular Formula C17H13Br2NO3
Exact Mass 436.926219 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JfJ8gMJCZoK
Name 4-(2-Bromo-4,5-dimethoxyphenyl)-5-(2-bromophenyl)isoxazole
Comments Less than 3 mono-isotopic peaks
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Formula C17H13Br2NO3
InChI InChI=1S/C17H13Br2NO3/c1-21-15-7-11(14(19)8-16(15)22-2)12-9-20-23-17(12)10-5-3-4-6-13(10)18/h3-9H,1-2H3
InChIKey APOAPNBXXIDUTK-UHFFFAOYSA-N
Molecular Weight 439.103 g/mol
SMILES c1noc(c1-c1c(cc(c(c1)OC)OC)Br)-c1c(cccc1)Br
SPLASH splash10-000i-0002900000-b33f67eb11a3ca8d9343
Source of Spectrum J-65-6410-21
Synonyms 4-(2-bromanyl-4,5-dimethoxy-phenyl)-5-(2-bromophenyl)-1,2-oxazole 4-(2-bromo-4,5-dimethoxyphenyl)-5-(2-bromophenyl)-1,2-oxazole
Wiley ID 1533315