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O,O-diethyl 4-nitrobenzylphosphonothioate
SpectraBase Compound ID CKgTFGV55Bm
InChI InChI=1S/C11H16NO4PS/c1-3-15-17(18,16-4-2)9-10-5-7-11(8-6-10)12(13)14/h5-8H,3-4,9H2,1-2H3
InChIKey MHESDCMSUDJKII-UHFFFAOYSA-N
Mol Weight 289.29 g/mol
Molecular Formula C11H16NO4PS
Exact Mass 289.053766 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7uW21pAmy1I
Name O,O-diethyl 4-nitrobenzylphosphonothioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16NO4PS
InChI InChI=1S/C11H16NO4PS/c1-3-15-17(18,16-4-2)9-10-5-7-11(8-6-10)12(13)14/h5-8H,3-4,9H2,1-2H3
InChIKey MHESDCMSUDJKII-UHFFFAOYSA-N
Literature Reference DOI 10.1002_(SICI)1098-1071(1998)9_2_201
Molecular Weight 289.286 g/mol
SMILES c1c(ccc(c1)[N+](=O)[O-])CP(OCC)(OCC)=S
SPLASH splash10-000i-0890000000-4758768a9cdd193058f6
Source of Spectrum HAC-9-207-1c
Synonyms O,O-diethyl (4-nitrobenzyl)phosphonothioate
Wiley ID 1783134