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Phosphoric acid, dimethyl 4-nitrophenyl ester
SpectraBase Compound ID IjReJmjX7cZ
InChI InChI=1S/C8H10NO6P/c1-13-16(12,14-2)15-8-5-3-7(4-6-8)9(10)11/h3-6H,1-2H3
InChIKey BAFQDKPJKOLXFZ-UHFFFAOYSA-N
Mol Weight 247.14 g/mol
Molecular Formula C8H10NO6P
Exact Mass 247.024574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L1N7NrfoooU
Name Methylparathion oxon
Source of Sample Metabolite of Methylparathion; Sigma-Aldrich Cat. #46192
CAS Registry Number 950-35-6
Classification Pesticides: Metabolites
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 247.024574038 u
Formula C8H10NO6P
InChI InChI=1S/C8H10NO6P/c1-13-16(12,14-2)15-8-5-3-7(4-6-8)9(10)11/h3-6H,1-2H3
InChIKey BAFQDKPJKOLXFZ-UHFFFAOYSA-N
Molecular Weight 247.143 g/mol
Number of Peaks 47
RI1 1806
SMILES c1cc(ccc1N(=O)=O)OP(=O)(OC)OC
SPLASH splash10-0a4j-8960000000-57d5b94ebc5cdb66a86e
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Phosphoric acid, dimethyl 4-nitrophenyl ester
Wiley ID LM_PEST_835