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(2S,3R,4R)-4-FORMYLOXY-2,3,5-TRIACETOXYPENTANOIC-ACID-METHYLESTER
SpectraBase Compound ID ELcdcqrNCz1
InChI InChI=1S/C13H18O10/c1-7(15)20-5-10(21-6-14)11(22-8(2)16)12(13(18)19-4)23-9(3)17/h6,10-12H,5H2,1-4H3/t10-,11-,12+/m1/s1
InChIKey HEJREFSTASOAHL-UTUOFQBUSA-N
Mol Weight 334.28 g/mol
Molecular Formula C13H18O10
Exact Mass 334.089997 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9zmiYnLzEnc
Name (2S,3R,4R)-2,3,5-triacetoxy-4-formyloxy-valeric acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O10
InChI InChI=1S/C13H18O10/c1-7(15)20-5-10(21-6-14)11(22-8(2)16)12(13(18)19-4)23-9(3)17/h6,10-12H,5H2,1-4H3/t10-,11-,12+/m1/s1
InChIKey HEJREFSTASOAHL-UTUOFQBUSA-N
Molecular Weight 334.277 g/mol
SMILES [C@@]([C@](OC(=O)C)([C@@](COC(=O)C)(OC=O)[H])[H])(C(=O)OC)(OC(=O)C)[H]
SPLASH splash10-0006-9030000000-869cd16e7ec3d2328e61
Source of Spectrum J-58-3171-2
Synonyms (2S,3R,4R)-2,3,5-triacetyloxy-4-formyloxypentanoic acid methyl ester Methyl (2S,3R,4R)-2,3,5-triacetoxy-4-formyloxy-pentanoate Methyl (2S,3R,4R)-2,3,5-triacetyloxy-4-formyloxypentanoate Methyl (2S,3R,4R)-2,3,5-triacetyloxy-4-methanoyloxy-pentanoate
Wiley ID 1330583