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(2S,4S,6S)-8-((tert-Butyldiphenylsilyl)oxy)-4-hydroxy-N-((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)-N,2,6-trimethyloctanamide
SpectraBase Compound ID 6RcU5Xalbgm
InChI InChI=1S/C36H51NO4Si/c1-27(25-31(38)26-28(2)35(40)37(7)29(3)34(39)30-17-11-8-12-18-30)23-24-41-42(36(4,5)6,32-19-13-9-14-20-32)33-21-15-10-16-22-33/h8-22,27-29,31,34,38-39H,23-26H2,1-7H3/t27-,28-,29-,31-,34+/m0/s1
InChIKey DCSARXPWDHIZFQ-JBLFZBBRSA-N
Mol Weight 589.9 g/mol
Molecular Formula C36H51NO4Si
Exact Mass 589.358736 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7zb9pxIZMpV
Name (2S,4S,6S)-8-((tert-Butyldiphenylsilyl)oxy)-4-hydroxy-N-((1S,2S)-1-hydroxy-1-phenylpropan-2-yl)-N,2,6-trimethyloctanamide
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H51NO4Si
InChI InChI=1S/C36H51NO4Si/c1-27(25-31(38)26-28(2)35(40)37(7)29(3)34(39)30-17-11-8-12-18-30)23-24-41-42(36(4,5)6,32-19-13-9-14-20-32)33-21-15-10-16-22-33/h8-22,27-29,31,34,38-39H,23-26H2,1-7H3/t27-,28-,29-,31-,34+/m0/s1
InChIKey DCSARXPWDHIZFQ-JBLFZBBRSA-N
Instrument Name Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.1002/chem.201804987
Molecular Weight 589.892 g/mol
Optical Rotation [a]D20 = +64.5 (c = 0.5, CHCl3)
Reported Formula C36H51N1O4Si
SMILES O[C@](C[C@@](C(N([C@]([C@@](O)(c1ccccc1)[H])(C)[H])C)=O)(C)[H])(C[C@](CCO[Si](c1ccccc1)(C(C)(C)C)c1ccccc1)(C)[H])[H]
SPLASH splash10-0532-7922030000-df976dc0ec5d879254b7
Sample Comments dr > 20:1
Source of Spectrum QE-25-SM11-27
Wiley ID 1845965