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(1S,5S,7S)-7-Benzyloxy-8,8-dimethyl-2,9-dioxabicyclo[3.3.1]nonan-3-one
SpectraBase Compound ID 8tongvALwY0
InChI InChI=1S/C16H20O4/c1-16(2)12(18-10-11-6-4-3-5-7-11)9-15-19-13(16)8-14(17)20-15/h3-7,12-13,15H,8-10H2,1-2H3/t12-,13-,15+/m0/s1
InChIKey YXJRTRFKBXLYFM-KCQAQPDRSA-N
Mol Weight 276.33 g/mol
Molecular Formula C16H20O4
Exact Mass 276.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JjssEgGb6tM
Name (1S,5S,7S)-7-Benzyloxy-8,8-dimethyl-2,9-dioxabicyclo[3.3.1]nonan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O4
InChI InChI=1S/C16H20O4/c1-16(2)12(18-10-11-6-4-3-5-7-11)9-15-19-13(16)8-14(17)20-15/h3-7,12-13,15H,8-10H2,1-2H3/t12-,13-,15+/m0/s1
InChIKey YXJRTRFKBXLYFM-KCQAQPDRSA-N
Molecular Weight 276.332 g/mol
SMILES [C@@]12(C([C@@](OCc3ccccc3)(C[C@](O1)(OC(C2)=O)[H])[H])(C)C)[H]
SPLASH splash10-0005-7910000000-783e0f89aa09d1eeb2da
Source of Spectrum QC-8-3916-3
Synonyms (1R,5S,7S)-7-(benzyloxy)-6,6-dimethyl-2,9-dioxabicyclo[3.3.1]nonan-3-one
Wiley ID 870284