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(S)-1,4-DI-O-TRITYL-3-O-BENZYL-1,3,4-TRIHYDROXYBUTAN-2-ONE
SpectraBase Compound ID 86mbG0qUlBw
InChI InChI=1S/C49H42O4/c50-46(37-52-48(40-24-10-2-11-25-40,41-26-12-3-13-27-41)42-28-14-4-15-29-42)47(51-36-39-22-8-1-9-23-39)38-53-49(43-30-16-5-17-31-43,44-32-18-6-19-33-44)45-34-20-7-21-35-45/h1-35,47H,36-38H2/t47-/m0/s1
InChIKey YDYPTSUMYZZTDC-MFERNQICSA-N
Mol Weight 694.9 g/mol
Molecular Formula C49H42O4
Exact Mass 694.30831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Eq70iYr38HN
Name (S)-1,4-DI-O-TRITYL-3-O-BENZYL-1,3,4-TRIHYDROXYBUTAN-2-ONE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C49H42O4
InChI InChI=1S/C49H42O4/c50-46(37-52-48(40-24-10-2-11-25-40,41-26-12-3-13-27-41)42-28-14-4-15-29-42)47(51-36-39-22-8-1-9-23-39)38-53-49(43-30-16-5-17-31-43,44-32-18-6-19-33-44)45-34-20-7-21-35-45/h1-35,47H,36-38H2/t47-/m0/s1
InChIKey YDYPTSUMYZZTDC-MFERNQICSA-N
Literature Reference Author J.A.MARCO,M.CARDA,F.GONZALEZ,S.RODRIGUEZ,E.CASTILLO,J.MURGA
Literature Reference Citation J.ORG.CHEM.,63,698(1998)
Literature Reference DOI 10.1021/jo9716744
Molecular Weight 694.870 g/mol
Sample ID 33294
Solvent Unknown