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1-(4-Chloro-phenylsulfonyl)-6-(4-methyl-phenoxy)-hexa-2,4-diyne
SpectraBase Compound ID 7b7ut8hLJ6a
InChI InChI=1S/C19H15ClO3S/c1-16-6-10-18(11-7-16)23-14-4-2-3-5-15-24(21,22)19-12-8-17(20)9-13-19/h6-13H,14-15H2,1H3
InChIKey KMUBUDJNHUKKNZ-UHFFFAOYSA-N
Mol Weight 358.84 g/mol
Molecular Formula C19H15ClO3S
Exact Mass 358.043043 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 92tC2S2zPuF
Name 1-(4-Chloro-phenylsulfonyl)-6-(4-methyl-phenoxy)-hexa-2,4-diyne
CAS Registry Number 119724-77-5
Comments SHIFTVALUE FOR C15 AND C17 AT 169.10 IS CHANGED TO 129.10 PPM (A.H.)
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Formula C19H15ClO3S
InChI InChI=1S/C19H15ClO3S/c1-16-6-10-18(11-7-16)23-14-4-2-3-5-15-24(21,22)19-12-8-17(20)9-13-19/h6-13H,14-15H2,1H3
InChIKey KMUBUDJNHUKKNZ-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference K.C. Majumdar, R.N. De, B.K.Sen, Magn. Res. Chem. 26, 626 (1988).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3