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Acetaminophen
SpectraBase Compound ID 4mhOpRnzTv6
InChI InChI=1S/C8H9NO2/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10)
InChIKey RZVAJINKPMORJF-UHFFFAOYSA-N
Mol Weight 151.16 g/mol
Molecular Formula C8H9NO2
Exact Mass 151.063329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1KpzBPrh4K
Name Paracetamol @
CAS Registry Number 103-90-2
Classification Analgesic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 151.063328532 u
Formula C8H9NO2
InChI InChI=1S/C8H9NO2/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10)
InChIKey RZVAJINKPMORJF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 151.165 g/mol
SMILES CC(Nc1ccc(O)cc1)=O
SPLASH splash10-0a4i-7900000000-214aa5a75235b99ea9de
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: G P U
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Acetaminophen Phenacetin-M (deethyl-)
Technique GC/MS
Wiley ID MMPW6e_825