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Phenacetin
SpectraBase Compound ID YcCeSaut19
InChI InChI=1S/C10H13NO2/c1-3-13-10-6-4-9(5-7-10)11-8(2)12/h4-7H,3H2,1-2H3,(H,11,12)
InChIKey CPJSUEIXXCENMM-UHFFFAOYSA-N
Mol Weight 179.22 g/mol
Molecular Formula C10H13NO2
Exact Mass 179.094629 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID DQvdz8u5EF
Name Phenacetin
CAS Registry Number 62-44-2
Collision Energy 30 eV
Copyright Copyright © 2012-2025 Herbert Oberacher. All Rights Reserved.
Exact Mass 179.094628661 u
Formula C10H13NO2
InChI InChI=1S/C10H13NO2/c1-3-13-10-6-4-9(5-7-10)11-8(2)12/h4-7H,3H2,1-2H3,(H,11,12)
InChIKey CPJSUEIXXCENMM-UHFFFAOYSA-N
Instrument Name QStar XL, AB Sciex
Ion Polarity P
Ionization Type ESI+
Molecular Weight 179.219 g/mol
Nominal Mass 179 u
Precursor Ion [M+H]+
Precursor m/z 180.102
SMILES N(C1=CC=C(OCC)C=C1)C(=O)C
Selected Ion Charge 1
Source of Spectrum Herbert Oberacher, Institute of Legal Medicine, Innsbruck/Austria
Spectrum Type ms2
Synonyms N-(4-ethoxyphenyl)acetamide
Technique Q-TOF
Wiley ID MSforID_+_721.14