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bis[3-Bromo-5-(trifluoromethyl)-biphenyl-4-yl]-methanol
SpectraBase Compound ID 4ZWHhBXUGlo
InChI InChI=1S/C27H16Br2F6O/c28-21-13-17(15-7-3-1-4-8-15)11-19(26(30,31)32)23(21)25(36)24-20(27(33,34)35)12-18(14-22(24)29)16-9-5-2-6-10-16/h1-14,25,36H
InChIKey KVIYORPKLINOPS-UHFFFAOYSA-N
Mol Weight 630.22 g/mol
Molecular Formula C27H16Br2F6O
Exact Mass 627.94721 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J95tBNC00KC
Name bis[3-Bromo-5-(trifluoromethyl)-biphenyl-4-yl]-methanol
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Formula C27H16Br2F6O
InChI InChI=1S/C27H16Br2F6O/c28-21-13-17(15-7-3-1-4-8-15)11-19(26(30,31)32)23(21)25(36)24-20(27(33,34)35)12-18(14-22(24)29)16-9-5-2-6-10-16/h1-14,25,36H
InChIKey KVIYORPKLINOPS-UHFFFAOYSA-N
Molecular Weight 630.222 g/mol
SMILES OC(c1c(C(F)(F)F)cc(cc1Br)-c1ccccc1)c1c(C(F)(F)F)cc(cc1Br)-c1ccccc1
SPLASH splash10-004i-0019001000-6a5d80d48505e5b924cf
Source of Spectrum C-128-966-12
Wiley ID 1701831