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(3R)-3-hydroxy-3-phenyl-propionic acid isopropyl ester
SpectraBase Compound ID GiTXFUfi0zg
InChI InChI=1S/C12H16O3/c1-9(2)15-12(14)8-11(13)10-6-4-3-5-7-10/h3-7,9,11,13H,8H2,1-2H3/t11-/m1/s1
InChIKey PQCWHPORJRGOMC-LLVKDONJSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1xFUFcKzyHi
Name (3R)-3-hydroxy-3-phenyl-propionic acid isopropyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-9(2)15-12(14)8-11(13)10-6-4-3-5-7-10/h3-7,9,11,13H,8H2,1-2H3/t11-/m1/s1
InChIKey PQCWHPORJRGOMC-LLVKDONJSA-N
Molecular Weight 208.257 g/mol
SMILES O[C@](CC(=O)OC(C)C)(c1ccccc1)[H]
SPLASH splash10-0a4i-3900000000-3a7ad4e31817c3e06e59
Source of Spectrum KC-61-2177-4
Synonyms (3R)-3-hydroxy-3-phenylpropanoic acid propan-2-yl ester isopropyl (3R)-3-hydroxy-3-phenyl-propanoate Propan-2-yl (3R)-3-hydroxy-3-phenylpropanoate Propan-2-yl (3R)-3-oxidanyl-3-phenyl-propanoate
Wiley ID 1627907