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(2S,3S,5S)-3,5-Diacetoxy-2-methylcyclohexanone
SpectraBase Compound ID A5XqjQ1Ck2l
InChI InChI=1S/C11H16O5/c1-6-10(14)4-9(15-7(2)12)5-11(6)16-8(3)13/h6,9,11H,4-5H2,1-3H3/t6-,9-,11+/m1/s1
InChIKey QXCMSWAGLJTSML-CGYDSVCVSA-N
Mol Weight 228.24 g/mol
Molecular Formula C11H16O5
Exact Mass 228.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A95F4Wv9DQS
Name (2S,3S,5S)-3,5-Diacetoxy-2-methylcyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O5
InChI InChI=1S/C11H16O5/c1-6-10(14)4-9(15-7(2)12)5-11(6)16-8(3)13/h6,9,11H,4-5H2,1-3H3/t6-,9-,11+/m1/s1
InChIKey QXCMSWAGLJTSML-CGYDSVCVSA-N
Molecular Weight 228.244 g/mol
SMILES [C@@]1([C@@](C(=O)C[C@](C1)(OC(=O)C)[H])(C)[H])(OC(=O)C)[H]
SPLASH splash10-0a59-9800000000-be815b735724bf4f3a9e
Source of Spectrum F-53-103-17
Synonyms (1S,2S,5S)-5-(acetyloxy)-2-methyl-3-oxocyclohexyl acetate
Wiley ID 799908