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(2E,4R,5R)-2,3-Dihydroxyhex-2-enyl benzoate
SpectraBase Compound ID Ah2qJbBHC0k
InChI InChI=1S/C13H16O4/c1-2-6-11(14)12(15)9-17-13(16)10-7-4-3-5-8-10/h3-5,7-8,14-15H,2,6,9H2,1H3/b12-11+
InChIKey GOHJGJUZZDAQOP-VAWYXSNFSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GfE9Yw1GeMA
Name (2E,4R,5R)-2,3-Dihydroxyhex-2-enyl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-2-6-11(14)12(15)9-17-13(16)10-7-4-3-5-8-10/h3-5,7-8,14-15H,2,6,9H2,1H3/b12-11+
InChIKey GOHJGJUZZDAQOP-VAWYXSNFSA-N
Molecular Weight 236.267 g/mol
SMILES O\C(=C\(COC(c1ccccc1)=O)O)CCC
SPLASH splash10-05fr-6900000000-b92c461fada810685e70
Source of Spectrum F-56-2277-0
Synonyms (2E)-2,3-dihydroxy-2-hexenyl benzoate
Wiley ID 856475