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4-[(p-Chlorophenyl)thio]-2-butynyl p-tolyl ether
SpectraBase Compound ID Fo4a43ltsjA
InChI InChI=1S/C17H15ClOS/c1-14-4-8-16(9-5-14)19-12-2-3-13-20-17-10-6-15(18)7-11-17/h4-11H,12-13H2,1H3
InChIKey HEUZCMUUQWWMLI-UHFFFAOYSA-N
Mol Weight 302.82 g/mol
Molecular Formula C17H15ClOS
Exact Mass 302.053214 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cfd8BFOdufA
Name 4-[(p-Chlorophenyl)thio]-2-butynyl p-tolyl ether
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 302.053213976 u
Formula C17H15ClOS
InChI InChI=1S/C17H15ClOS/c1-14-4-8-16(9-5-14)19-12-2-3-13-20-17-10-6-15(18)7-11-17/h4-11H,12-13H2,1H3
InChIKey HEUZCMUUQWWMLI-UHFFFAOYSA-N
SMILES C=1C(=CC=C(C1)Cl)SCC#CCOC=1C=CC(=CC1)C