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(2S,3R)-1-Diphenylphosphinoyl-2-propylhexan-3-ol
SpectraBase Compound ID 4lfL82qg1zn
InChI InChI=1S/C21H29O2P/c1-3-11-18(21(22)12-4-2)17-24(23,19-13-7-5-8-14-19)20-15-9-6-10-16-20/h5-10,13-16,18,21-22H,3-4,11-12,17H2,1-2H3/t18-,21-/m1/s1
InChIKey KWDBFIAOKJBBEB-WIYYLYMNSA-N
Mol Weight 344.43 g/mol
Molecular Formula C21H29O2P
Exact Mass 344.190517 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 40FHz8AIPDS
Name (2S,3R)-1-Diphenylphosphinoyl-2-propylhexan-3-ol
Alternate Name(s) (4R,5S)-5-[(diphenylphosphoryl)methyl]-4-octanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29O2P
InChI InChI=1S/C21H29O2P/c1-3-11-18(21(22)12-4-2)17-24(23,19-13-7-5-8-14-19)20-15-9-6-10-16-20/h5-10,13-16,18,21-22H,3-4,11-12,17H2,1-2H3/t18-,21-/m1/s1
InChIKey KWDBFIAOKJBBEB-WIYYLYMNSA-N
Molecular Weight 344.435 g/mol
SMILES O[C@@]([C@@](CP(=O)(c1ccccc1)c1ccccc1)(CCC)[H])(CCC)[H]
SPLASH splash10-0udi-0096000000-af68bcfd8cc82fb8676a
Source of Spectrum KC-0-3429-21
Wiley ID 829558