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(rac)-4-Bromo[2.2]paracyclophane
SpectraBase Compound ID cRJLSZFfnb
InChI InChI=1S/C16H15Br/c17-16-11-14-6-5-12-1-3-13(4-2-12)7-9-15(16)10-8-14/h1-4,8,10-11H,5-7,9H2
InChIKey RJOYWTPJYZNRJD-UHFFFAOYSA-N
Mol Weight 287.2 g/mol
Molecular Formula C16H15Br
Exact Mass 286.035713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3I3VO94H6li
Name (rac)-4-Bromo[2.2]paracyclophane
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15Br
InChI InChI=1S/C16H15Br/c17-16-11-14-6-5-12-1-3-13(4-2-12)7-9-15(16)10-8-14/h1-4,8,10-11H,5-7,9H2
InChIKey RJOYWTPJYZNRJD-UHFFFAOYSA-N
Instrument Name Finnigan, MAT 90
Ionization Type EI
Literature Reference DOI 10.1002/chem.202003709
Molecular Weight 287.200 g/mol
Reported Formula C16H15(79)Br
SMILES c12ccc(cc2)CCc2ccc(c(c2)Br)CC1
SPLASH splash10-0udr-0930000000-9987c5bf460016d56fb9
Source of Spectrum QE-26-SM5-5-1
Thin-Layer Chromatography Rf = 0.63 (cyclohexane/ethyl acetate, 50:1)
Wiley ID 1841089