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(1S,2R)-2-diphenylphosphoryl-1-(4-methoxyphenyl)-3-methyl-butan-1-ol

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(1S,2R)-2-diphenylphosphoryl-1-(4-methoxyphenyl)-3-methyl-butan-1-ol
SpectraBase Compound ID 298JpWapy2s
InChI InChI=1S/C24H27O3P/c1-18(2)24(23(25)19-14-16-20(27-3)17-15-19)28(26,21-10-6-4-7-11-21)22-12-8-5-9-13-22/h4-18,23-25H,1-3H3/t23-,24+/m0/s1
InChIKey OBCROBKVQGDHKO-BJKOFHAPSA-N
Mol Weight 394.45 g/mol
Molecular Formula C24H27O3P
Exact Mass 394.169782 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID oj8tASWkCC
Name (1S,2R)-2-Diphenylphosphoryl-1-(4-methoxyphenyl)-3-methyl-butan-1-ol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 394.169781724 u
Formula C24H27O3P
InChI InChI=1S/C24H27O3P/c1-18(2)24(23(25)19-14-16-20(27-3)17-15-19)28(26,21-10-6-4-7-11-21)22-12-8-5-9-13-22/h4-18,23-25H,1-3H3/t23-,24+/m0/s1
InChIKey OBCROBKVQGDHKO-BJKOFHAPSA-N
Molecular Weight 394.451 g/mol
SMILES [C@@](P(=O)(C1=CC=CC=C1)C=1C=CC=CC1)([C@](C1=CC=C(C=C1)OC)(O)[H])(C(C)C)[H]