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(3S,4S,5S,6S)-3,6-Diacetoxy-4,5-(isopropylidenedioxy)cyclohexene
SpectraBase Compound ID 1w7AUgujsdy
InChI InChI=1S/C13H18O6/c1-7(14)16-9-5-6-10(17-8(2)15)12-11(9)18-13(3,4)19-12/h5-6,9-12H,1-4H3/t9-,10-,11-,12-/m0/s1
InChIKey BWJDYPUWDGBXQB-BJDJZHNGSA-N
Mol Weight 270.28 g/mol
Molecular Formula C13H18O6
Exact Mass 270.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ibd4OHKTicN
Name (3S,4S,5S,6S)-3,6-Diacetoxy-4,5-(isopropylidenedioxy)cyclohexene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O6
InChI InChI=1S/C13H18O6/c1-7(14)16-9-5-6-10(17-8(2)15)12-11(9)18-13(3,4)19-12/h5-6,9-12H,1-4H3/t9-,10-,11-,12-/m0/s1
InChIKey BWJDYPUWDGBXQB-BJDJZHNGSA-N
Molecular Weight 270.281 g/mol
SMILES [C@]12([C@@](OC(O2)(C)C)([C@@](OC(=O)C)(C=C[C@@]1(OC(=O)C)[H])[H])[H])[H]
SPLASH splash10-0006-9530000000-123ef00626e771c9b14d
Source of Spectrum F-56-2201-35
Synonyms (3aS,4S,7S,7aS)-7-(acetyloxy)-2,2-dimethyl-3a,4,7,7a-tetrahydro-1,3-benzodioxol-4-yl acetate
Wiley ID 856504