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phosphorothioic acid, O,O-dimethyl O-4-nitro-m-tolyl ester
SpectraBase Compound ID JQPNT1QaTLM
InChI InChI=1S/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3
InChIKey ZNOLGFHPUIJIMJ-UHFFFAOYSA-N
Mol Weight 277.23 g/mol
Molecular Formula C9H12NO5PS
Exact Mass 277.017381 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JBgzOXAqJWI
Name FENITROTHION;O,O-DIEMTHYL-O-(3-METHYL-4-NITROPHENYL)-PHOSPHOROTHIOATE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H12NO5PS
InChI InChI=1S/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3
InChIKey ZNOLGFHPUIJIMJ-UHFFFAOYSA-N
Literature Reference Author D.L.CRUICKSHANK,N.M.ROUGIER,R.V.VICO,S.A.BOURNE,E.I.BUJAN,M. R.CAIRA,R.H.DEROSSI
Literature Reference Citation BEIL.J.ORG.CHEM.,9,106(2013)
Literature Reference DOI 10.3762/bjoc.9.14
Solvent CDCl3
Source File Reference UWLU76960