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Dimethyl 4-phenylbenzylphosphonate
SpectraBase Compound ID B61m8hkzukN
InChI InChI=1S/C15H17O3P/c1-17-19(16,18-2)12-13-8-10-15(11-9-13)14-6-4-3-5-7-14/h3-11H,12H2,1-2H3
InChIKey XXZJCCGJCSXNJP-UHFFFAOYSA-N
Mol Weight 276.27 g/mol
Molecular Formula C15H17O3P
Exact Mass 276.091531 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A1lDL2KLUjY
Name Dimethyl 4-phenylbenzylphosphonate
Alternate Name(s) 4-[(dimethoxyphosphoryl)methyl]-1,1'-biphenyl dimethyl[1,1'-biphenyl]-4-ylmethylphosphonate 1-(dimethoxyphosphorylmethyl)-4-phenylbenzene
Comments Less than 3 mono-isotopic peaks
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Formula C15H17O3P
InChI InChI=1S/C15H17O3P/c1-17-19(16,18-2)12-13-8-10-15(11-9-13)14-6-4-3-5-7-14/h3-11H,12H2,1-2H3
InChIKey XXZJCCGJCSXNJP-UHFFFAOYSA-N
Molecular Weight 276.272 g/mol
SMILES C(P(=O)(OC)OC)c1ccc(cc1)-c1ccccc1
SPLASH splash10-014i-0940000000-bdd3cbc16a40d805f77d
Source of Spectrum F-54-1701-16
Wiley ID 805894