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O,O-Dibutyl S-(2'-phenylvinyl)-phosphorothioate
SpectraBase Compound ID 3FUMomjQbA0
InChI InChI=1S/C16H25O3PS/c1-3-5-13-18-20(17,19-14-6-4-2)21-15-12-16-10-8-7-9-11-16/h7-12,15H,3-6,13-14H2,1-2H3/b15-12+
InChIKey IOKNALVGNQVNEJ-NTCAYCPXSA-N
Mol Weight 328.41 g/mol
Molecular Formula C16H25O3PS
Exact Mass 328.126203 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JeZZA8CUGAA
Name O,O-Dibutyl S-(2'-phenylvinyl)-phosphorothioate
Alternate Name(s) O,O-dibutyl S-[(E)-2-phenylethenyl]thiophosphate [(E)-2-(dibutoxyphosphorylthio)ethenyl]benzene [(E)-2-dibutoxyphosphorylsulfanylvinyl]benzene [(E)-2-dibutoxyphosphorylsulfanylethenyl]benzene
Comments Less than 3 mono-isotopic peaks
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Formula C16H25O3PS
InChI InChI=1S/C16H25O3PS/c1-3-5-13-18-20(17,19-14-6-4-2)21-15-12-16-10-8-7-9-11-16/h7-12,15H,3-6,13-14H2,1-2H3/b15-12+
InChIKey IOKNALVGNQVNEJ-NTCAYCPXSA-N
Molecular Weight 328.407 g/mol
SMILES c1(\C=C\SP(=O)(OCCCC)OCCCC)ccccc1
SPLASH splash10-0udi-0903000000-8c5cb2648081b4f5c6c8
Source of Spectrum SK-29-3610-3
Wiley ID 880820