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2-(8-bromo-1,3-difluoro-2-phenanthrenyl)-3,3,3-trifluoro-2-hydroxypropanoic acid ethyl ester
SpectraBase Compound ID 5EQaTkYyEgq
InChI InChI=1S/C19H12BrF5O3/c1-2-28-17(26)18(27,19(23,24)25)15-14(21)8-12-9-4-3-5-13(20)10(9)6-7-11(12)16(15)22/h3-8,27H,2H2,1H3
InChIKey POBPBWXHZSURDQ-UHFFFAOYSA-N
Mol Weight 463.2 g/mol
Molecular Formula C19H12BrF5O3
Exact Mass 461.988998 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 25fc6khuUK
Name 2-(8-bromo-1,3-difluoro-2-phenanthrenyl)-3,3,3-trifluoro-2-hydroxypropanoic acid ethyl ester
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Formula C19H12BrF5O3
InChI InChI=1S/C19H12BrF5O3/c1-2-28-17(26)18(27,19(23,24)25)15-14(21)8-12-9-4-3-5-13(20)10(9)6-7-11(12)16(15)22/h3-8,27H,2H2,1H3
InChIKey POBPBWXHZSURDQ-UHFFFAOYSA-N
Molecular Weight 463.198 g/mol
SMILES OC(C(=O)OCC)(C(F)(F)F)c1c(c2c(cc1F)c1cccc(c1cc2)Br)F
SPLASH splash10-03k9-0049300000-11ec48b477c7a3915acd
Source of Spectrum F-70-620-29
Synonyms 2-(8-bromo-1,3-difluoro-2-phenanthryl)-3,3,3-trifluoro-2-hydroxy-propionic acid ethyl ester Ethyl 2-(8-bromo-1,3-difluoro-2-phenanthryl)-3,3,3-trifluoro-2-hydroxy-propanoate Ethyl 2-(8-bromo-1,3-difluorophenanthren-2-yl)-3,3,3-trifluoro-2-hydroxypropanoate Ethyl 2-[8-bromanyl-1,3-bis(fluoranyl)phenanthren-2-yl]-3,3,3-tris(fluoranyl)-2-oxidanyl-propanoate
Wiley ID 1596091