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1-O-(22-Hydroxydocosyl)-d-mannitol
SpectraBase Compound ID I9z4dlzsqQp
InChI InChI=1S/C28H58O7/c29-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-35-24-26(32)28(34)27(33)25(31)23-30/h25-34H,1-24H2/t25-,26-,27-,28-/m1/s1
InChIKey ISNXCUWYAFLVDK-BIYDSLDMSA-N
Mol Weight 506.8 g/mol
Molecular Formula C28H58O7
Exact Mass 506.418254 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1g2tIX5Wnw
Name 1-O-(22-Hydroxydocosyl)-d-mannitol
CAS Registry Number 119049-22-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H58O7
InChI InChI=1S/C28H58O7/c29-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-35-24-26(32)28(34)27(33)25(31)23-30/h25-34H,1-24H2/t25-,26-,27-,28-/m1/s1
InChIKey ISNXCUWYAFLVDK-BIYDSLDMSA-N
Molecular Weight 506.765 g/mol
SMILES O[C@](CO)([C@]([C@@]([C@@](COCCCCCCCCCCCCCCCCCCCCCCO)(O)[H])(O)[H])(O)[H])[H]
SPLASH splash10-0abc-9200000000-20ca704abe783c3fa894
Source of Spectrum HE-1986-2326-0
Synonyms 6-(22-hydroxydocosoxy)hexane-1,2,3,4,5-pentol 6-(22-oxidanyldocosoxy)hexane-1,2,3,4,5-pentol d-Mannitol, 1-O-(22-hydroxydocosyl)-
Wiley ID 1399864