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Quinalphos
SpectraBase Compound ID BFAmB8bgwE
InChI InChI=1S/C12H15N2O3PS/c1-3-15-18(19,16-4-2)17-12-9-13-10-7-5-6-8-11(10)14-12/h5-9H,3-4H2,1-2H3
InChIKey JYQUHIFYBATCCY-UHFFFAOYSA-N
Mol Weight 298.3 g/mol
Molecular Formula C12H15N2O3PS
Exact Mass 298.054101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 36deW45OOzT
Name Quinalphos
Source of Sample Sigma-Aldrich Cat. #45651
CAS Registry Number 13593-03-8
Classification Pesticides: Insecticides
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 298.054100520 u
Formula C12H15N2O3PS
InChI InChI=1S/C12H15N2O3PS/c1-3-15-18(19,16-4-2)17-12-9-13-10-7-5-6-8-11(10)14-12/h5-9H,3-4H2,1-2H3
InChIKey JYQUHIFYBATCCY-UHFFFAOYSA-N
Molecular Weight 298.297 g/mol
Number of Peaks 49
RI1 2066
SMILES CCOP(OCC)(Oc1cnc2ccccc2n1)=S
SPLASH splash10-05mn-5900000000-dec1d726424dfb10013c
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 Phosphorothioic acid, O,O-diethyl O-2-quinoxalinyl ester
Wiley ID LM_PEST_48