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(3S,4R)-anti/syn-4-Hydroxy-3-methyl-4-phenylbutan-2-one
SpectraBase Compound ID LuV1LasMAST
InChI InChI=1S/C11H14O2/c1-8(9(2)12)11(13)10-6-4-3-5-7-10/h3-8,11,13H,1-2H3/t8-,11-/m1/s1
InChIKey PSMPCPHOQAAKLW-LDYMZIIASA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID qtgynE27c
Name (3S,4R)-anti/syn-4-Hydroxy-3-methyl-4-phenylbutan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-8(9(2)12)11(13)10-6-4-3-5-7-10/h3-8,11,13H,1-2H3/t8-,11-/m1/s1
InChIKey PSMPCPHOQAAKLW-LDYMZIIASA-N
Molecular Weight 178.231 g/mol
SMILES O[C@]([C@@](C(=O)C)(C)[H])(c1ccccc1)[H]
SPLASH splash10-05i0-9700000000-a0588a258d3815a9519d
Source of Spectrum SO-0-818-9
Synonyms (3S,4R)-4-hydroxy-3-methyl-4-phenyl-2-butanone anti/syn-4-Hydroxy-3-methyl-4-phenylbutan-2-one
Wiley ID 1545775