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1,4-Butanediol, 2-(diphenylphosphinyl)-2-methyl-1-phenyl-, (R*,S*)-
SpectraBase Compound ID JVVBnTSu6ub
InChI InChI=1S/C23H25O3P/c1-23(17-18-24,22(25)19-11-5-2-6-12-19)27(26,20-13-7-3-8-14-20)21-15-9-4-10-16-21/h2-16,22,24-25H,17-18H2,1H3/t22-,23+/m0/s1
InChIKey WKXBNOHMWFFWKC-XZOQPEGZSA-N
Mol Weight 380.42 g/mol
Molecular Formula C23H25O3P
Exact Mass 380.154132 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6MylBLN5jmX
Name 1,4-Butanediol, 2-(diphenylphosphinyl)-2-methyl-1-phenyl-, (R*,S*)-
Alternate Name(s) (1S,2R)-2-(diphenylphosphoryl)-2-methyl-1-phenyl-1,4-butanediol Threo-2-diphenylphosphinoyl-2-methyl-1-phenylbutane-1,4-diol
CAS Registry Number 89625-20-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H25O3P
InChI InChI=1S/C23H25O3P/c1-23(17-18-24,22(25)19-11-5-2-6-12-19)27(26,20-13-7-3-8-14-20)21-15-9-4-10-16-21/h2-16,22,24-25H,17-18H2,1H3/t22-,23+/m0/s1
InChIKey WKXBNOHMWFFWKC-XZOQPEGZSA-N
Molecular Weight 380.424 g/mol
SMILES O[C@]([C@@](CCO)(P(=O)(c1ccccc1)c1ccccc1)C)(c1ccccc1)[H]
SPLASH splash10-0006-0095000000-120e851cb05eac80b0ca
Source of Spectrum KC-1988-2976-16
Wiley ID 1359867