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1-(chloromethyl)-4-cyclohexylbenzene
SpectraBase Compound ID LjQJQSFr2sO
InChI InChI=1S/C13H17Cl/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h6-9,12H,1-5,10H2
InChIKey DNEPVPBJDHQGRK-UHFFFAOYSA-N
Mol Weight 208.73 g/mol
Molecular Formula C13H17Cl
Exact Mass 208.101878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ZhoBKZC08
Name 1-(chloromethyl)-4-cyclohexylbenzene
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17Cl
InChI InChI=1S/C13H17Cl/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h6-9,12H,1-5,10H2
InChIKey DNEPVPBJDHQGRK-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI positive ion
Literature Reference DOI 10.1002/anie.202002528
Molecular Weight 208.732 g/mol
Reported Formula C13H17Cl
SMILES c1cc(ccc1CCl)C1CCCCC1
SPLASH splash10-0q4l-1920000000-4a035ecf7993973fc2dd
Source of Spectrum ACI-59-SM13-4f
Thin-Layer Chromatography Rf = 0.34 (Hexane)
Wiley ID 1857902