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O-Ethyl,O-phenyl,O-(E)-1-{1-[(2-chlorothiazol-5-yl)methyl]-5-methyl-1H-1,2,3-triazol-4-yl}ethylidene amino thiophosphate
SpectraBase Compound ID A7tSCZgI5ug
InChI InChI=1S/C17H19ClN5O3PS2/c1-4-24-27(28,25-14-8-6-5-7-9-14)26-21-12(2)16-13(3)23(22-20-16)11-15-10-19-17(18)29-15/h5-10H,4,11H2,1-3H3/b21-12+
InChIKey RJPUXVLCNFKOJV-CIAFOILYSA-N
Mol Weight 471.92 g/mol
Molecular Formula C17H19ClN5O3PS2
Exact Mass 471.035547 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2zTMEtGbj4u
Name O-Ethyl,O-phenyl,O-(E)-1-{1-[(2-chlorothiazol-5-yl)methyl]-5-methyl-1H-1,2,3-triazol-4-yl}ethylidene amino thiophosphate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19ClN5O3PS2
InChI InChI=1S/C17H19ClN5O3PS2/c1-4-24-27(28,25-14-8-6-5-7-9-14)26-21-12(2)16-13(3)23(22-20-16)11-15-10-19-17(18)29-15/h5-10H,4,11H2,1-3H3/b21-12+
InChIKey RJPUXVLCNFKOJV-CIAFOILYSA-N
Literature Reference DOI 10.1002/cjoc.200990092
Molecular Weight 471.918 g/mol
SMILES c1nc(sc1C[n]1c(c(\C(=N\OP(OCC)(=S)Oc2ccccc2)C)nn1)C)Cl
SPLASH splash10-003u-9540000000-089af0da2bcdbb35ba63
Source of Spectrum CJC-27-567-4a
Synonyms (E)-O-ethyl O-phenyl ((1-(1-((2-chlorothiazol-5-yl)methyl)-5-methyl-1H-1,2,3-triazol-4-yl)ethylidene)amino)oxyphosphonothioate
Wiley ID 1772287