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(2S,3S,4R)-1,3,4-tribenzyloxyoctadecan-2-amine

View entire compound with spectra: 1 MS (GC)

(2S,3S,4R)-1,3,4-tribenzyloxyoctadecan-2-amine
SpectraBase Compound ID 3I9n3DnknIm
InChI InChI=1S/C39H57NO3/c1-2-3-4-5-6-7-8-9-10-11-12-22-29-38(42-31-35-25-18-14-19-26-35)39(43-32-36-27-20-15-21-28-36)37(40)33-41-30-34-23-16-13-17-24-34/h13-21,23-28,37-39H,2-12,22,29-33,40H2,1H3/t37-,38+,39-/m0/s1
InChIKey GSMYSRYDJTZQSX-PQRPKFJBSA-N
Mol Weight 587.9 g/mol
Molecular Formula C39H57NO3
Exact Mass 587.433845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Acx4P3R7z0U
Name (2S,3S,4R)-1,3,4-tribenzyloxyoctadecan-2-amine
Alternate Name(s) (2S,3S,4R)-1,3,4-tris(phenylmethoxy)-2-octadecanamine (2S,3S,4R)-1,3,4-tris(phenylmethoxy)octadecan-2-amine [(1S,2S,3R)-2,3-dibenzoxy-1-(benzoxymethyl)heptadecyl]amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C39H57NO3
InChI InChI=1S/C39H57NO3/c1-2-3-4-5-6-7-8-9-10-11-12-22-29-38(42-31-35-25-18-14-19-26-35)39(43-32-36-27-20-15-21-28-36)37(40)33-41-30-34-23-16-13-17-24-34/h13-21,23-28,37-39H,2-12,22,29-33,40H2,1H3/t37-,38+,39-/m0/s1
InChIKey GSMYSRYDJTZQSX-PQRPKFJBSA-N
Molecular Weight 587.889 g/mol
SMILES N[C@]([C@](OCc1ccccc1)([C@](OCc1ccccc1)(CCCCCCCCCCCCCC)[H])[H])(COCc1ccccc1)[H]
SPLASH splash10-0006-9401000000-865adcf8b96500d37a45
Source of Spectrum KC-0-2852-29
Wiley ID 782334