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(S)-8,8'-ph2vanol phosphorus oxychloride
SpectraBase Compound ID AfezJhFtAoq
InChI InChI=1S/C44H28ClO3P/c45-49(46)47-43-39-33(23-13-25-35(39)29-15-5-1-6-16-29)27-37(31-19-9-3-10-20-31)41(43)42-38(32-21-11-4-12-22-32)28-34-24-14-26-36(40(34)44(42)48-49)30-17-7-2-8-18-30/h1-28H
InChIKey OZVWNLSULSXASF-UHFFFAOYSA-N
Mol Weight 671.1 g/mol
Molecular Formula C44H28ClO3P
Exact Mass 670.146459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FTHKPZw2mK
Name (S)-8,8'-ph2vanol phosphorus oxychloride
Comments Less than 3 mono-isotopic peaks
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Formula C44H28ClO3P
InChI InChI=1S/C44H28ClO3P/c45-49(46)47-43-39-33(23-13-25-35(39)29-15-5-1-6-16-29)27-37(31-19-9-3-10-20-31)41(43)42-38(32-21-11-4-12-22-32)28-34-24-14-26-36(40(34)44(42)48-49)30-17-7-2-8-18-30/h1-28H
InChIKey OZVWNLSULSXASF-UHFFFAOYSA-N
Molecular Weight 671.132 g/mol
SMILES c12OP(Oc3c(-c2c(-c2ccccc2)cc2c1c(-c1ccccc1)ccc2)c(cc1c3c(ccc1)-c1ccccc1)-c1ccccc1)(=O)Cl
SPLASH splash10-00di-0000009000-7a99922853b6a8e563ed
Source of Spectrum F4-42-3677-7
Wiley ID 1674460