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4-[(Dimethylphosphono)methyl]phenylacetic acid benzyl ester
SpectraBase Compound ID 1IVaU3HsEMz
InChI InChI=1S/C18H21O5P/c1-21-24(20,22-2)14-17-10-8-15(9-11-17)12-18(19)23-13-16-6-4-3-5-7-16/h3-11H,12-14H2,1-2H3
InChIKey JSSCMHVYFKRHDM-UHFFFAOYSA-N
Mol Weight 348.33 g/mol
Molecular Formula C18H21O5P
Exact Mass 348.112661 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DHBe8cMdIn7
Name 4-[(Dimethylphosphono)methyl]phenylacetic acid benzyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C18H21O5P
InChI InChI=1S/C18H21O5P/c1-21-24(20,22-2)14-17-10-8-15(9-11-17)12-18(19)23-13-16-6-4-3-5-7-16/h3-11H,12-14H2,1-2H3
InChIKey JSSCMHVYFKRHDM-UHFFFAOYSA-N
Molecular Weight 348.335 g/mol
SMILES C(P(=O)(OC)OC)c1ccc(CC(=O)OCc2ccccc2)cc1
SPLASH splash10-03di-0092000000-6c89be77d702b97e52ea
Source of Spectrum F-54-1703-33
Synonyms benzyl {4-[(dimethoxyphosphoryl)methyl]phenyl}acetate
Wiley ID 805889