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1-Diphenylphiosphinoylheptan-3-yl benzoate

View entire compound with spectra: 1 MS (GC)

1-Diphenylphiosphinoylheptan-3-yl benzoate
SpectraBase Compound ID GH24z4zD24T
InChI InChI=1S/C26H29O3P/c1-2-3-15-23(29-26(27)22-13-7-4-8-14-22)20-21-30(28,24-16-9-5-10-17-24)25-18-11-6-12-19-25/h4-14,16-19,23H,2-3,15,20-21H2,1H3/t23-/m1/s1
InChIKey SOYRYRZDBMHAFL-HSZRJFAPSA-N
Mol Weight 420.49 g/mol
Molecular Formula C26H29O3P
Exact Mass 420.185432 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ibgCAtoSiX
Name 1-Diphenylphiosphinoylheptan-3-yl benzoate
Alternate Name(s) (1R)-1-[2-(diphenylphosphoryl)ethyl]pentyl benzoate (R)-1-Diphenylphiosphinoylheptan-3-yl benzoate benzoic acid[(1R)-1-(2-diphenylphosphorylethyl)pentyl]ester benzoic acid[(3R)-1-diphenylphosphorylheptan-3-yl]ester [(3R)-1-diphenylphosphorylheptan-3-yl]benzoate benzoic acid [(3R)-1-diphenylphosphorylheptan-3-yl] ester [(1R)-1-(2-diphenylphosphorylethyl)pentyl] benzoate [(3R)-1-diphenylphosphorylheptan-3-yl] benzoate
Comments Less than 3 mono-isotopic peaks
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Formula C26H29O3P
InChI InChI=1S/C26H29O3P/c1-2-3-15-23(29-26(27)22-13-7-4-8-14-22)20-21-30(28,24-16-9-5-10-17-24)25-18-11-6-12-19-25/h4-14,16-19,23H,2-3,15,20-21H2,1H3/t23-/m1/s1
InChIKey SOYRYRZDBMHAFL-HSZRJFAPSA-N
Molecular Weight 420.489 g/mol
SMILES C(P(=O)(c1ccccc1)c1ccccc1)C[C@](OC(=O)c1ccccc1)(CCCC)[H]
SPLASH splash10-014i-0009000000-30d3a8af3999aa0a1efa
Source of Spectrum KC-0-3420-26
Wiley ID 829585