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

*Links on SpectraBase are not permalinks.
PHORATE, OXYGEN ANALOG
SpectraBase Compound ID BIPt6iXOPqY
InChI InChI=1S/C7H17O2PS3/c1-4-8-10(11,9-5-2)13-7-12-6-3/h4-7H2,1-3H3
InChIKey BULVZWIRKLYCBC-UHFFFAOYSA-N
Mol Weight 260.36 g/mol
Molecular Formula C7H17O2PS3
Exact Mass 260.01283 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 FZJeGge1txq
Name Phorate
Source of Sample Sigma-Aldrich Cat. #33388
CAS Registry Number 298-02-2
Classification Pesticides: Insecticides, Nematicides
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 260.012830305 u
Formula C7H17O2PS3
InChI InChI=1S/C7H17O2PS3/c1-4-8-10(11,9-5-2)13-7-12-6-3/h4-7H2,1-3H3
InChIKey BULVZWIRKLYCBC-UHFFFAOYSA-N
Molecular Weight 260.365 g/mol
Number of Peaks 50
RI1 1685
SMILES CCOP(=S)(OCC)SCSCC
SPLASH splash10-004i-9310000000-ec07b1e6dec5f72ce1a1
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 Phosphorodithioic acid, O,O-diethyl S-[(ethylthio)methyl] ester
Wiley ID LM_PEST_32