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Diethyl (1-methylthiohept-3-en-1-yl)phosphonate
SpectraBase Compound ID 1uBUNq43xz5
InChI InChI=1S/C12H25O3PS/c1-5-8-9-10-11-12(17-4)16(13,14-6-2)15-7-3/h9-10,12H,5-8,11H2,1-4H3/b10-9+
InChIKey XWHMTSWILHGBIY-MDZDMXLPSA-N
Mol Weight 280.36 g/mol
Molecular Formula C12H25O3PS
Exact Mass 280.126203 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CD2X17pWAxc
Name Diethyl (1-methylthiohept-3-en-1-yl)phosphonate
Alternate Name(s) Diethyl (3E)-1-(methylsulfanyl)-3-heptenylphosphonate
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Formula C12H25O3PS
InChI InChI=1S/C12H25O3PS/c1-5-8-9-10-11-12(17-4)16(13,14-6-2)15-7-3/h9-10,12H,5-8,11H2,1-4H3/b10-9+
InChIKey XWHMTSWILHGBIY-MDZDMXLPSA-N
Molecular Weight 280.363 g/mol
SMILES C(P(=O)(OCC)OCC)(SC)C\C=C\CCC
SPLASH splash10-0udj-4900000000-e19d82b38761d9cb71e4
Source of Spectrum QB-18-251-2
Wiley ID 841764