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Paracetamol HFB               @
SpectraBase Compound ID 6qrbnGCULij
InChI InChI=1S/C12H8F7NO3/c1-6(21)20-7-2-4-8(5-3-7)23-9(22)10(13,14)11(15,16)12(17,18)19/h2-5H,1H3,(H,20,21)
InChIKey BONJYQQQOFCHPC-UHFFFAOYSA-N
Mol Weight 347.19 g/mol
Molecular Formula C12H8F7NO3
Exact Mass 347.03924 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4FYAmfWhg1q
Name Paracetamol HFB @
Classification Analgesic
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Exact Mass 347.039240260 u
Formula C12H8F7NO3
InChI InChI=1S/C12H8F7NO3/c1-6(21)20-7-2-4-8(5-3-7)23-9(22)10(13,14)11(15,16)12(17,18)19/h2-5H,1H3,(H,20,21)
InChIKey BONJYQQQOFCHPC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 347.189 g/mol
SMILES C(C(C(Oc1ccc(NC(=O)C)cc1)=O)(F)F)(C(F)(F)F)(F)F
SPLASH splash10-0a4i-7904000000-3089ed1c2e6b1dc7ba53
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.
Sample Preparation Procedure Detected: UHYHFB PHFB
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Acetaminophen HFB MeOPP-M (4-aminophenol N-acetyl-) HFB Phenacetin-M HFB
Technique GC/MS
Wiley ID MMPW6e_5099