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2-(p-Hydroxybenzyl)-2-[(diphenylphosphanyl)methyl]-1,3-bis(diphenylphosphanyl)-propane
SpectraBase Compound ID 3MmL8AbvBOm
InChI InChI=1S/C47H43OP3/c48-40-33-31-39(32-34-40)35-47(36-49(41-19-7-1-8-20-41)42-21-9-2-10-22-42,37-50(43-23-11-3-12-24-43)44-25-13-4-14-26-44)38-51(45-27-15-5-16-28-45)46-29-17-6-18-30-46/h1-34,48H,35-38H2
InChIKey WKVCBEOIZVLWRD-UHFFFAOYSA-N
Mol Weight 716.8 g/mol
Molecular Formula C47H43OP3
Exact Mass 716.252677 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9HeGsShOf5x
Name 2-(p-Hydroxybenzyl)-2-[(diphenylphosphanyl)methyl]-1,3-bis(diphenylphosphanyl)-propane
Alternate Name(s) 1,3-phenylene-19-crown-6
Comments Less than 3 mono-isotopic peaks
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Formula C47H43OP3
InChI InChI=1S/C47H43OP3/c48-40-33-31-39(32-34-40)35-47(36-49(41-19-7-1-8-20-41)42-21-9-2-10-22-42,37-50(43-23-11-3-12-24-43)44-25-13-4-14-26-44)38-51(45-27-15-5-16-28-45)46-29-17-6-18-30-46/h1-34,48H,35-38H2
InChIKey WKVCBEOIZVLWRD-UHFFFAOYSA-N
Molecular Weight 716.781 g/mol
SMILES Oc1ccc(CC(CP(c2ccccc2)c2ccccc2)(CP(c2ccccc2)c2ccccc2)CP(c2ccccc2)c2ccccc2)cc1
SPLASH splash10-000i-0000009100-17928e1d30bf3c2eb55b
Source of Spectrum AG-571-279-0
Wiley ID 1415536