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Benzeneacetic acid, .alpha.-ethyl-, methyl ester
SpectraBase Compound ID Ipap3pcgPBK
InChI InChI=1S/C11H14O2/c1-3-10(11(12)13-2)9-7-5-4-6-8-9/h4-8,10H,3H2,1-2H3
InChIKey PPIQQNDMGXNRFA-UHFFFAOYSA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H9pO9CMuyC3
Name Butethamate-M/artifact (HOOC-) ME
Classification Anticholinergic
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Exact Mass 178.099379689 u
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-3-10(11(12)13-2)9-7-5-4-6-8-9/h4-8,10H,3H2,1-2H3
InChIKey PPIQQNDMGXNRFA-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 178.231 g/mol
SMILES C(=O)(OC)C(CC)c1ccccc1
SPLASH splash10-00kf-9600000000-447d8ff42e099fe77a3a
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: UME
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_2911