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1-Chloro-2-hex-1-ynyl-3,5-dimethoxybenzene
SpectraBase Compound ID 5MlIo7OJ9vi
InChI InChI=1S/C14H17ClO2/c1-4-5-6-7-8-12-13(15)9-11(16-2)10-14(12)17-3/h9-10H,4-6H2,1-3H3
InChIKey OXISYCXGKCEWHZ-UHFFFAOYSA-N
Mol Weight 252.74 g/mol
Molecular Formula C14H17ClO2
Exact Mass 252.091707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ffH6H3hnFP
Name 1-Chloro-2-hex-1-ynyl-3,5-dimethoxybenzene
Appearance Brown oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17ClO2
InChI InChI=1S/C14H17ClO2/c1-4-5-6-7-8-12-13(15)9-11(16-2)10-14(12)17-3/h9-10H,4-6H2,1-3H3
InChIKey OXISYCXGKCEWHZ-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.7.146
Molecular Weight 252.741 g/mol
Reported Formula C14H17ClO2
SMILES c1c(cc(Cl)c(C#CCCCC)c1OC)OC
SPLASH splash10-0udi-0490000000-0c972639f4245906d90c
Source of Spectrum BJO-7-SM9-6a
Thin-Layer Chromatography Rf = 0.23 (hexane/EtOAc, 9:1)
Wiley ID 1867098