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O,O-Diethyl .alpha.-[1-(2-chloro-thiazol-5-ylmethyl)-5-methyl-1H-1,2,3-triazol-4-ylcarbonyloxy]benzylphosphonate
SpectraBase Compound ID YJZn5X444v
InChI InChI=1S/C19H22ClN4O5PS/c1-4-27-30(26,28-5-2)18(14-9-7-6-8-10-14)29-17(25)16-13(3)24(23-22-16)12-15-11-21-19(20)31-15/h6-11,18H,4-5,12H2,1-3H3
InChIKey QAPFTCHYVUBVLO-UHFFFAOYSA-N
Mol Weight 484.89 g/mol
Molecular Formula C19H22ClN4O5PS
Exact Mass 484.073706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IeeiIe4vrfC
Name O,O-Diethyl .alpha.-[1-(2-chloro-thiazol-5-ylmethyl)-5-methyl-1H-1,2,3-triazol-4-ylcarbonyloxy]benzylphosphonate
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Formula C19H22ClN4O5PS
InChI InChI=1S/C19H22ClN4O5PS/c1-4-27-30(26,28-5-2)18(14-9-7-6-8-10-14)29-17(25)16-13(3)24(23-22-16)12-15-11-21-19(20)31-15/h6-11,18H,4-5,12H2,1-3H3
InChIKey QAPFTCHYVUBVLO-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.200790342
Molecular Weight 484.895 g/mol
SMILES C(OP(OCC)(C(OC(=O)c1nn[n](Cc2sc(Cl)nc2)c1C)c1ccccc1)=O)C
SPLASH splash10-000x-8593500000-ab80fc09888769f904f6
Source of Spectrum CJC-25-1857-7a
Synonyms (diethoxyphosphoryl)(phenyl)methyl 1-((2-chlorothiazol-5-yl)methyl)-5-methyl-1H-1,2,3-triazole-4-carboxylate 1-[(2-chloro-5-thiazolyl)methyl]-5-methyl-4-triazolecarboxylic acid [diethoxyphosphoryl(phenyl)methyl] ester [diethoxyphosphoryl(phenyl)methyl] 1-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyltriazole-4-carboxylate [diethoxyphosphoryl(phenyl)methyl] 1-[(2-chlorothiazol-5-yl)methyl]-5-methyl-triazole-4-carboxylate [diethoxyphosphoryl(phenyl)methyl] 1-[(2-chloranyl-1,3-thiazol-5-yl)methyl]-5-methyl-1,2,3-triazole-4-carboxylate
Wiley ID 1774395