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Benzamide, N-[2-(diphenylphosphinyl)-3-hydroxy-1,1,4-trimethylpentyl]-, (R*,R*)-(.+-.)-
SpectraBase Compound ID IQ5rK9bpA0W
InChI InChI=1S/C27H32NO3P/c1-20(2)24(29)25(27(3,4)28-26(30)21-14-8-5-9-15-21)32(31,22-16-10-6-11-17-22)23-18-12-7-13-19-23/h5-20,24-25,29H,1-4H3,(H,28,30)/t24-,25+/m1/s1
InChIKey CDEQYIFOJHOSAZ-RPBOFIJWSA-N
Mol Weight 449.5 g/mol
Molecular Formula C27H32NO3P
Exact Mass 449.211981 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CdlNYgYdnJz
Name Benzamide, N-[2-(diphenylphosphinyl)-3-hydroxy-1,1,4-trimethylpentyl]-, (R*,R*)-(.+-.)-
CAS Registry Number 114893-85-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H32NO3P
InChI InChI=1S/C27H32NO3P/c1-20(2)24(29)25(27(3,4)28-26(30)21-14-8-5-9-15-21)32(31,22-16-10-6-11-17-22)23-18-12-7-13-19-23/h5-20,24-25,29H,1-4H3,(H,28,30)/t24-,25+/m1/s1
InChIKey CDEQYIFOJHOSAZ-RPBOFIJWSA-N
Molecular Weight 449.531 g/mol
SMILES N(C([C@]([C@@](C(C)C)(O)[H])(P(=O)(c1ccccc1)c1ccccc1)[H])(C)C)C(=O)c1ccccc1
SPLASH splash10-0002-0090000000-3d7e7d7f6721aad4cfb6
Source of Spectrum KC-1987-1895-31
Synonyms N-[(2R,3R)-2-(diphenylphosphoryl)-3-hydroxy-1,1,4-trimethylpentyl]benzamide Threo-5-benzamido-4-diphenylphosphinoyl-2,5-dimethylhexa-3-ol
Wiley ID 1387490