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(3S,4S)-3-(chloromethyl)-4-(3-fluorophenyl)-4-hydroxy-2-butanone
SpectraBase Compound ID 4F7uKYMfYh2
InChI InChI=1S/C11H12ClFO2/c1-7(14)10(6-12)11(15)8-3-2-4-9(13)5-8/h2-5,10-11,15H,6H2,1H3/t10-,11-/m1/s1
InChIKey PIXKOQQUHLMSGH-GHMZBOCLSA-N
Mol Weight 230.67 g/mol
Molecular Formula C11H12ClFO2
Exact Mass 230.050985 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C4Ui1PMvLrQ
Name (3S,4S)-3-(chloromethyl)-4-(3-fluorophenyl)-4-hydroxy-2-butanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12ClFO2
InChI InChI=1S/C11H12ClFO2/c1-7(14)10(6-12)11(15)8-3-2-4-9(13)5-8/h2-5,10-11,15H,6H2,1H3/t10-,11-/m1/s1
InChIKey PIXKOQQUHLMSGH-GHMZBOCLSA-N
Molecular Weight 230.666 g/mol
SMILES O[C@@]([C@@](C(=O)C)(CCl)[H])(c1cc(F)ccc1)[H]
SPLASH splash10-004i-9100000000-27eca7ef841563a69f22
Source of Spectrum J-66-410-1
Synonyms (3S,4S)-3-(chloromethyl)-4-(3-fluorophenyl)-4-hydroxybutan-2-one (3S,4S)-3-(chloromethyl)-4-(3-fluorophenyl)-4-oxidanyl-butan-2-one
Wiley ID 1534259