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4-Hydroxyphenylacetic acid HFB      @
SpectraBase Compound ID 2zMvu1j1loY
InChI InChI=1S/C12H7F7O4/c13-10(14,11(15,16)12(17,18)19)9(22)23-7-3-1-6(2-4-7)5-8(20)21/h1-4H,5H2,(H,20,21)
InChIKey YFFQPAXTHQIDIH-UHFFFAOYSA-N
Mol Weight 348.17 g/mol
Molecular Formula C12H7F7O4
Exact Mass 348.023256 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1suAWzCJwLn
Name 4-Hydroxyphenylacetic acid HFB @
Classification Biomolecule Disinfectant
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Exact Mass 348.023255842 u
Formula C12H7F7O4
InChI InChI=1S/C12H7F7O4/c13-10(14,11(15,16)12(17,18)19)9(22)23-7-3-1-6(2-4-7)5-8(20)21/h1-4H,5H2,(H,20,21)
InChIKey YFFQPAXTHQIDIH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 348.173 g/mol
SMILES c1(ccc(cc1)OC(C(C(C(F)(F)F)(F)F)(F)F)=O)CC(O)=O
SPLASH splash10-0v00-9314000000-ed560c3df558869e1047
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Phenylethanol-M (HO-phenylacetic acid) HFB
Technique GC/MS
Wiley ID MMPW6e_5956