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DL-3-O-Methyl-2,6-di-O-benzyl-myo-inositol
SpectraBase Compound ID IDY8EWQKpLl
InChI InChI=1S/C21H26O6/c1-25-20-17(23)16(22)19(26-12-14-8-4-2-5-9-14)18(24)21(20)27-13-15-10-6-3-7-11-15/h2-11,16-24H,12-13H2,1H3/t16-,17-,18-,19+,20+,21-/m1/s1
InChIKey ADWQNFNJFFOCIC-COXXTLHVSA-N
Mol Weight 374.43 g/mol
Molecular Formula C21H26O6
Exact Mass 374.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ACBmb9JMDWa
Name DL-3-O-Methyl-2,6-di-O-benzyl-myo-inositol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O6
InChI InChI=1S/C21H26O6/c1-25-20-17(23)16(22)19(26-12-14-8-4-2-5-9-14)18(24)21(20)27-13-15-10-6-3-7-11-15/h2-11,16-24H,12-13H2,1H3/t16-,17-,18-,19+,20+,21-/m1/s1
InChIKey ADWQNFNJFFOCIC-COXXTLHVSA-N
Molecular Weight 374.433 g/mol
SMILES O[C@@]1([C@]([C@@]([C@@]([C@@]([C@]1(OCc1ccccc1)[H])(O)[H])(OCc1ccccc1)[H])(OC)[H])(O)[H])[H]
SPLASH splash10-001l-5920000000-f1510cb580111195f4f3
Source of Spectrum J-62-8339-20
Synonyms (1R,2R,3S,4R,5R,6S)-3,5-bis(benzyloxy)-6-methoxy-1,2,4-cyclohexanetriol
Wiley ID 1356665