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(2S)-2-(4-fluorophenyl)propanoic acid
SpectraBase Compound ID 6qKMZ0CbDuH
InChI InChI=1S/C9H9FO2/c1-6(9(11)12)7-2-4-8(10)5-3-7/h2-6H,1H3,(H,11,12)/t6-/m0/s1
InChIKey IXSCGBODJGIJNN-LURJTMIESA-N
Mol Weight 168.17 g/mol
Molecular Formula C9H9FO2
Exact Mass 168.058658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 16IK8ZAucV0
Name (2S)-2-(4-fluorophenyl)propanoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C9H9FO2
InChI InChI=1S/C9H9FO2/c1-6(9(11)12)7-2-4-8(10)5-3-7/h2-6H,1H3,(H,11,12)/t6-/m0/s1
InChIKey IXSCGBODJGIJNN-LURJTMIESA-N
Molecular Weight 168.167 g/mol
SMILES OC([C@](c1ccc(cc1)F)(C)[H])=O
SPLASH splash10-00di-0900000000-0fb3eae3c84bed31804f
Source of Spectrum QC-12-3310-11
Synonyms (2S)-2-(4-fluorophenyl)propionic acid
Wiley ID 1634903