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phosphorodithioic acid, S-[(2,5-dichlorobenzo[b]thien-3-yl)methyl] O-ethyl S-propyl ester
SpectraBase Compound ID BEzjMqC5bOd
InChI InChI=1S/C14H17Cl2O2PS3/c1-3-7-20-19(17,18-4-2)21-9-12-11-8-10(15)5-6-13(11)22-14(12)16/h5-6,8H,3-4,7,9H2,1-2H3
InChIKey WANJAPWHCOVASB-UHFFFAOYSA-N
Mol Weight 415.35 g/mol
Molecular Formula C14H17Cl2O2PS3
Exact Mass 413.950536 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FZanWd1dKte
Name phosphorodithioic acid, S-[(2,5-dichlorobenzo[b]thien-3-yl)methyl] O-ethyl S-propyl ester
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Formula C14H17Cl2O2PS3
InChI InChI=1S/C14H17Cl2O2PS3/c1-3-7-20-19(17,18-4-2)21-9-12-11-8-10(15)5-6-13(11)22-14(12)16/h5-6,8H,3-4,7,9H2,1-2H3
InChIKey WANJAPWHCOVASB-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 55367M
Solvent CDCl3