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1-(2-Bromo-5-chlorophenyl)adamantane
SpectraBase Compound ID 51tBxZMZwjx
InChI InChI=1S/C16H18BrCl/c17-15-2-1-13(18)6-14(15)16-7-10-3-11(8-16)5-12(4-10)9-16/h1-2,6,10-12H,3-5,7-9H2
InChIKey IUYIVLDIWQJACW-UHFFFAOYSA-N
Mol Weight 325.68 g/mol
Molecular Formula C16H18BrCl
Exact Mass 324.028041 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7HhI0BrnmuX
Name 1-(2-Bromo-5-chlorophenyl)adamantane
Appearance White crystalline solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18BrCl
InChI InChI=1S/C16H18BrCl/c17-15-2-1-13(18)6-14(15)16-7-10-3-11(8-16)5-12(4-10)9-16/h1-2,6,10-12H,3-5,7-9H2
InChIKey IUYIVLDIWQJACW-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI positive ion
Literature Reference DOI 10.1002/anie.202001326
Molecular Weight 325.677 g/mol
Reported Formula C16H18(79)Br(35)Cl
SMILES c1(ccc(c(c1)C12CC3CC(CC(C3)C1)C2)Br)Cl
SPLASH splash10-002u-5923000000-0b94412c82865abc9f9c
Source of Spectrum ACI-59-SM14-11c
Thin-Layer Chromatography Rf = 0.80 (hexane)
Wiley ID 1857868