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(3aS,4R,5S,6r,7aR)-6-(Hydroxymethyl)-2,2-dimethyl-perhydro-1,3-benzodioxole-4,5-diol
SpectraBase Compound ID Fki02McXWwj
InChI InChI=1S/C10H18O5/c1-10(2)14-6-3-5(4-11)7(12)8(13)9(6)15-10/h5-9,11-13H,3-4H2,1-2H3/t5-,6-,7+,8-,9-/m1/s1
InChIKey KZBJAZJCBNFQTH-SYHAXYEDSA-N
Mol Weight 218.25 g/mol
Molecular Formula C10H18O5
Exact Mass 218.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ZcZaWytep9
Name (3aS,4R,5S,6r,7aR)-6-(Hydroxymethyl)-2,2-dimethyl-perhydro-1,3-benzodioxole-4,5-diol
Alternate Name(s) (3aS,4R,5S,6R,7aR)-6-(hydroxymethyl)-2,2-dimethylhexahydrobenzo[d][1,3]dioxole-4,5-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O5
InChI InChI=1S/C10H18O5/c1-10(2)14-6-3-5(4-11)7(12)8(13)9(6)15-10/h5-9,11-13H,3-4H2,1-2H3/t5-,6-,7+,8-,9-/m1/s1
InChIKey KZBJAZJCBNFQTH-SYHAXYEDSA-N
Molecular Weight 218.249 g/mol
SMILES O[C@]1([C@](C[C@@]2([C@]([C@@]1(O)[H])(OC(O2)(C)C)[H])[H])(CO)[H])[H]
SPLASH splash10-0a4i-9200000000-bb7944623daec06c9217
Source of Spectrum F5-3-1960-26
Wiley ID 1732329