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(1R,2R,4S,5S.6R,4'S)-5-Hydroxymethyl-4-methoxymethoxy-1-methyl-6-(2',2'-dimethyl-1',3'-dioxolan-4'-yl)bicxyclo[2.2.2]octane-2-ol

View entire compound with spectra: 1 MS (GC)

(1R,2R,4S,5S.6R,4'S)-5-Hydroxymethyl-4-methoxymethoxy-1-methyl-6-(2',2'-dimethyl-1',3'-dioxolan-4'-yl)bicxyclo[2.2.2]octane-2-ol
SpectraBase Compound ID 3CoIPkYv4mh
InChI InChI=1S/C17H30O6/c1-15(2)21-9-12(23-15)14-11(8-18)17(22-10-20-4)6-5-16(14,3)13(19)7-17/h11-14,18-19H,5-10H2,1-4H3/t11-,12-,13-,14+,16+,17+/m1/s1
InChIKey GPWSQZJPABVOJB-QQURXWMSSA-N
Mol Weight 330.42 g/mol
Molecular Formula C17H30O6
Exact Mass 330.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 66pyCYDvyfL
Name (1R,2R,4S,5S.6R,4'S)-5-Hydroxymethyl-4-methoxymethoxy-1-methyl-6-(2',2'-dimethyl-1',3'-dioxolan-4'-yl)bicxyclo[2.2.2]octane-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H30O6
InChI InChI=1S/C17H30O6/c1-15(2)21-9-12(23-15)14-11(8-18)17(22-10-20-4)6-5-16(14,3)13(19)7-17/h11-14,18-19H,5-10H2,1-4H3/t11-,12-,13-,14+,16+,17+/m1/s1
InChIKey GPWSQZJPABVOJB-QQURXWMSSA-N
Molecular Weight 330.421 g/mol
SMILES OC[C@@]1([C@]([C@]2(CC[C@@]1(C[C@]2(O)[H])OCOC)C)([C@@]1(OC(C)(C)OC1)[H])[H])[H]
SPLASH splash10-0udi-0901000000-3bb377bec258e2a538dc
Source of Spectrum F-50-669-12
Synonyms (1R,2R,4S,5S,6R)-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-5-(hydroxymethyl)-4-(methoxymethoxy)-1-methylbicyclo[2.2.2]octan-2-ol
Wiley ID 1327724