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3-Oxo-2-phenylbutanamide II
SpectraBase Compound ID 7WmnCsmOB0c
InChI InChI=1S/C10H11NO2/c1-7(12)9(10(11)13)8-5-3-2-4-6-8/h2-6,9H,1H3,(H2,11,13)
InChIKey FBISRXJSJBLOHX-UHFFFAOYSA-N
Mol Weight 177.2 g/mol
Molecular Formula C10H11NO2
Exact Mass 177.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHBtFvtXrqC
Name 3-Oxo-2-phenylbutanamide I
CAS Registry Number 4433-77-6
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 177.078978596 u
Formula C10H11NO2
InChI InChI=1S/C10H11NO2/c1-7(12)9(10(11)13)8-5-3-2-4-6-8/h2-6,9H,1H3,(H2,11,13)
InChIKey FBISRXJSJBLOHX-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 177.203 g/mol
Nominal Mass 177 u
Quality 995
Retention Index 1350
SMILES NC(C(C=1C=CC=CC1)C(=O)C)=O
SPLASH splash10-02tc-4900000000-f4a9871ae870c904b4ee
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms APAA
Technique GC/MS
Wiley ID DD2024_024716