For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Phosphorothioic acid, O-(3-chloro-4-nitrophenyl) O,O-dimethyl ester
SpectraBase Compound ID 2ZiB2KfS9ZM
InChI InChI=1S/C8H9ClNO5PS/c1-13-16(17,14-2)15-6-3-4-8(10(11)12)7(9)5-6/h3-5H,1-2H3
InChIKey NZNRRXXETLSZRO-UHFFFAOYSA-N
Mol Weight 297.65 g/mol
Molecular Formula C8H9ClNO5PS
Exact Mass 296.962758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8mzclm5dN2D
Name Chlorthion methyl
Source of Sample Sigma-Aldrich Cat. #35030
CAS Registry Number 500-28-7
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 296.962758261 u
Formula C8H9ClNO5PS
InChI InChI=1S/C8H9ClNO5PS/c1-13-16(17,14-2)15-6-3-4-8(10(11)12)7(9)5-6/h3-5H,1-2H3
InChIKey NZNRRXXETLSZRO-UHFFFAOYSA-N
Molecular Weight 297.649 g/mol
Number of Peaks 48
RI1 2001
SMILES COP(OC)(Oc1ccc(c(c1)Cl)N(=O)=O)=S
SPLASH splash10-056s-4930000000-c6dad48c1ecd53cb661b
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-(3-chloro-4-nitrophenyl) O,O-dimethyl ester
Wiley ID LM_PEST_778