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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 67findxVecr
Name (rac)-4-Bromo[2.2]paracyclophane
Appearance Colourless solid
Copyright Copyright © 2020-2025 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 95
Ionization Type EI
Literature Reference DOI 10.1002/chem.201704115
Quality 103
Reported Formula C16H15(79)Br
SMILES C12=CC=C(C=C2)CCC=2C(=CC(=CC2)CC1)Br
SPLASH splash10-0udi-0930000000-fc6dd8615fcaea14a733
Source of Spectrum QE-23-SM5-(rac)-S5 (DOI: 10.1002/chem.201704115)
Thin-Layer Chromatography 0.75 (pentane/ethyl acetate, 90:10)
Wiley ID 1906004