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(2S,3R,4R)-2-Amino-4-methyl-docosane-1,3-diol
SpectraBase Compound ID 1L6m0cnRS64
InChI InChI=1S/C22H47NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21(25)22(26)20(23)19-24/h20-22,24-26H,2-19,23H2,1H3/t20-,21+,22-/m0/s1
InChIKey AXTDXTXGBCSUKI-BDTNDASRSA-N
Mol Weight 373.6 g/mol
Molecular Formula C22H47NO3
Exact Mass 373.355594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IOm4vBr8Pkk
Name (2S,3R,4R)-2-Amino-4-methyl-docosane-1,3-diol
Alternate Name(s) 2-Aminodocosane-1,3,4-triol (2S,3S,4R)-2-azanyldocosane-1,3,4-triol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H47NO3
InChI InChI=1S/C22H47NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21(25)22(26)20(23)19-24/h20-22,24-26H,2-19,23H2,1H3/t20-,21+,22-/m0/s1
InChIKey AXTDXTXGBCSUKI-BDTNDASRSA-N
Molecular Weight 373.622 g/mol
SMILES N[C@]([C@@]([C@](O)(CCCCCCCCCCCCCCCCCC)[H])(O)[H])(CO)[H]
SPLASH splash10-03di-9001000000-d8991b79a0f5b52f6cbe
Source of Spectrum AF-49-5836-4
Wiley ID 1694159