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(2S,3S,4E)-2-(N,N-Dibenzylamino)-1-O-(tert-butyldimethylsilyl)-4-octadecyne-1,3-diol
SpectraBase Compound ID 1j8HHRs64Ix
InChI InChI=1S/C38H61NO2Si/c1-7-8-9-10-11-12-13-14-15-16-17-18-25-30-37(40)36(33-41-42(5,6)38(2,3)4)39(31-34-26-21-19-22-27-34)32-35-28-23-20-24-29-35/h19-24,26-29,36-37,40H,7-18,31-33H2,1-6H3/t36-,37-/m0/s1
InChIKey RIHFJHFEQGSHEV-BCRBLDSWSA-N
Mol Weight 592.0 g/mol
Molecular Formula C38H61NO2Si
Exact Mass 591.447157 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1VWmGIwYpSc
Name (2S,3S,4E)-2-(N,N-Dibenzylamino)-1-O-(tert-butyldimethylsilyl)-4-octadecyne-1,3-diol
Alternate Name(s) (2S,3S)-1-{[tert-butyl(dimethyl)silyl]oxy}-2-(dibenzylamino)-4-octadecyn-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H61NO2Si
InChI InChI=1S/C38H61NO2Si/c1-7-8-9-10-11-12-13-14-15-16-17-18-25-30-37(40)36(33-41-42(5,6)38(2,3)4)39(31-34-26-21-19-22-27-34)32-35-28-23-20-24-29-35/h19-24,26-29,36-37,40H,7-18,31-33H2,1-6H3/t36-,37-/m0/s1
InChIKey RIHFJHFEQGSHEV-BCRBLDSWSA-N
Molecular Weight 591.996 g/mol
SMILES O[C@@](C#CCCCCCCCCCCCCC)([C@@](N(Cc1ccccc1)Cc1ccccc1)(CO[Si](C(C)(C)C)(C)C)[H])[H]
SPLASH splash10-0udi-4009000000-a5ede0a2804a8531c9c0
Source of Spectrum QC-9-2497-4
Wiley ID 870664