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1-O-Acetyl-3-O-benzylpropane-1,2,3-triol
SpectraBase Compound ID 2sPweY8akcP
InChI InChI=1S/C12H16O4/c1-10(13)16-9-12(14)8-15-7-11-5-3-2-4-6-11/h2-6,12,14H,7-9H2,1H3/t12-/m1/s1
InChIKey VVZFZQPMMMTEQX-GFCCVEGCSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ARdpujEgo7x
Name 1-O-Acetyl-3-O-benzylpropane-1,2,3-triol
Alternate Name(s) (2S)-3-(benzyloxy)-2-hydroxypropyl acetate Acetic acid (R)-3-benzyloxy-2-hydroxy-propyl ester Acetic acid [(2R)-2-hydroxy-3-phenylmethoxypropyl] ester [(2R)-2-hydroxy-3-phenylmethoxypropyl] acetate [(2R)-3-benzyloxy-2-hydroxy-propyl] acetate [(2R)-2-oxidanyl-3-phenylmethoxy-propyl] ethanoate
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Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-10(13)16-9-12(14)8-15-7-11-5-3-2-4-6-11/h2-6,12,14H,7-9H2,1H3/t12-/m1/s1
InChIKey VVZFZQPMMMTEQX-GFCCVEGCSA-N
Molecular Weight 224.256 g/mol
SMILES O[C@@](COC(=O)C)(COCc1ccccc1)[H]
SPLASH splash10-0006-9100000000-5ef3384206a657cda323
Source of Spectrum QC-4-856-1
Wiley ID 883327