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1-[(E)-2-diphenoxyphosphorylethenyl]-4-(methylthio)benzene
SpectraBase Compound ID LBM7ohJInum
InChI InChI=1S/C21H19O3PS/c1-26-21-14-12-18(13-15-21)16-17-25(22,23-19-8-4-2-5-9-19)24-20-10-6-3-7-11-20/h2-17H,1H3/b17-16+
InChIKey NPXGQMHQWNSSHV-WUKNDPDISA-N
Mol Weight 382.41 g/mol
Molecular Formula C21H19O3PS
Exact Mass 382.079253 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID In98cnb4IQU
Name 1-[(E)-2-diphenoxyphosphorylethenyl]-4-(methylthio)benzene
Comments Less than 3 mono-isotopic peaks
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Formula C21H19O3PS
InChI InChI=1S/C21H19O3PS/c1-26-21-14-12-18(13-15-21)16-17-25(22,23-19-8-4-2-5-9-19)24-20-10-6-3-7-11-20/h2-17H,1H3/b17-16+
InChIKey NPXGQMHQWNSSHV-WUKNDPDISA-N
Molecular Weight 382.414 g/mol
SMILES c1(\C=C\P(Oc2ccccc2)(Oc2ccccc2)=O)ccc(cc1)SC
SPLASH splash10-001i-0029000000-ed291f999c6821a09c1e
Source of Spectrum KC-20-2956-5
Synonyms 1-[(E)-2-diphenoxyphosphorylethenyl]-4-methylsulfanyl-benzene 1-[(E)-2-diphenoxyphosphorylvinyl]-4-(methylthio)benzene 1-[(E)-2-diphenoxyphosphorylvinyl]-4-methylsulfanyl-benzene
Wiley ID 826542