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Thiophosphoric acid, o-[5-allyl-6-methyl-2-(4-pyridyl)-4-pyrimidyl] O,O-diethyl ester
SpectraBase Compound ID 235oXFqXYzh
InChI InChI=1S/C17H22N3O3PS/c1-5-8-15-13(4)19-16(14-9-11-18-12-10-14)20-17(15)23-24(25,21-6-2)22-7-3/h5,9-12H,1,6-8H2,2-4H3
InChIKey NIYJNPBKRNILNA-UHFFFAOYSA-N
Mol Weight 379.41 g/mol
Molecular Formula C17H22N3O3PS
Exact Mass 379.11195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dt8i8albVyo
Name Thiophosphoric acid, o-[5-allyl-6-methyl-2-(4-pyridyl)-4-pyrimidyl] O,O-diethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22N3O3PS
InChI InChI=1S/C17H22N3O3PS/c1-5-8-15-13(4)19-16(14-9-11-18-12-10-14)20-17(15)23-24(25,21-6-2)22-7-3/h5,9-12H,1,6-8H2,2-4H3
InChIKey NIYJNPBKRNILNA-UHFFFAOYSA-N
Molecular Weight 379.415 g/mol
SMILES c1(nc(-c2ccncc2)nc(c1CC=C)C)OP(=S)(OCC)OCC
SPLASH splash10-004i-5393000000-deb05a78e9bff0f3fa33
Source of Spectrum AD-0-2532-0
Synonyms Diethoxy-[(6-methyl-5-prop-2-enyl-2-pyridin-4-yl-4-pyrimidinyl)oxy]-sulfanylidenephosphorane [5-allyl-6-methyl-2-(4-pyridyl)pyrimidin-4-yl]oxy-diethoxy-thioxo-phosphorane Diethoxy-(6-methyl-5-prop-2-enyl-2-pyridin-4-ylpyrimidin-4-yl)oxy-sulfanylidene-$l^{5}-phosphane [5-allyl-6-methyl-2-(4-pyridyl)pyrimidin-4-yl]oxy-diethoxy-thioxo-$l^{5}-phosphane
Wiley ID 1434268