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Diethyl (phenylthio)heptylphosphonate

View entire compound with spectra: 1 MS (GC)

Diethyl (phenylthio)heptylphosphonate
SpectraBase Compound ID 4TCsaatiDRC
InChI InChI=1S/C17H29O3PS/c1-3-19-21(18,20-4-2)15-11-6-5-7-12-16-22-17-13-9-8-10-14-17/h8-10,13-14H,3-7,11-12,15-16H2,1-2H3
InChIKey NIUWSUFNUGNWNH-UHFFFAOYSA-N
Mol Weight 344.45 g/mol
Molecular Formula C17H29O3PS
Exact Mass 344.157503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 82JV1vObx6V
Name Diethyl (phenylthio)heptylphosphonate
Alternate Name(s) Diethyl 7-(phenylsulfanyl)heptylphosphonate
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Formula C17H29O3PS
InChI InChI=1S/C17H29O3PS/c1-3-19-21(18,20-4-2)15-11-6-5-7-12-16-22-17-13-9-8-10-14-17/h8-10,13-14H,3-7,11-12,15-16H2,1-2H3
InChIKey NIUWSUFNUGNWNH-UHFFFAOYSA-N
Molecular Weight 344.450 g/mol
SMILES C(OP(=O)(OCC)CCCCCCCSc1ccccc1)C
SPLASH splash10-05fr-0953000000-ddbb3d63f0b48cebef5f
Source of Spectrum QB-19-230-5
Wiley ID 841921