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Acetic acid (1R,2R,3R,5R,6S)-2,3,6-triacetoxy-5-acetoxymethyl-cyclohexyl ester
SpectraBase Compound ID EiUxoVrbmOa
InChI InChI=1S/C17H24O10/c1-8(18)23-7-13-6-14(24-9(2)19)16(26-11(4)21)17(27-12(5)22)15(13)25-10(3)20/h13-17H,6-7H2,1-5H3/t13-,14-,15+,16-,17-/m1/s1
InChIKey NHQQATCRVHXHKV-NQNKBUKLSA-N
Mol Weight 388.37 g/mol
Molecular Formula C17H24O10
Exact Mass 388.136947 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HVnwyCMFqsp
Name Acetic acid (1R,2R,3R,5R,6S)-2,3,6-triacetoxy-5-acetoxymethyl-cyclohexyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O10
InChI InChI=1S/C17H24O10/c1-8(18)23-7-13-6-14(24-9(2)19)16(26-11(4)21)17(27-12(5)22)15(13)25-10(3)20/h13-17H,6-7H2,1-5H3/t13-,14-,15+,16-,17-/m1/s1
InChIKey NHQQATCRVHXHKV-NQNKBUKLSA-N
Molecular Weight 388.369 g/mol
SMILES [C@]1([C@@]([C@](OC(=O)C)(C[C@@]([C@@]1(OC(=O)C)[H])(COC(=O)C)[H])[H])(OC(=O)C)[H])(OC(=O)C)[H]
SPLASH splash10-0006-9773000000-910ec9a6d35f8150ff43
Source of Spectrum F5-3-1960-27
Synonyms [(1R,2R,3R,4S,5R)-2,3,4,5-tetrakis(Acetyloxy)cyclohexyl]methyl Acetate (1R,2R,3R,4S,5R)-5-(acetoxymethyl)cyclohexane-1,2,3,4-tetrayl tetraacetate
Wiley ID 1732327