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Phenylbutazone-M (oxo-) ME    @
SpectraBase Compound ID FSgYTqmdaOW
InChI InChI=1S/C20H20N2O3/c1-15(23)13-14-18-19(24)21(16-9-5-3-6-10-16)22(20(18)25-2)17-11-7-4-8-12-17/h3-12H,13-14H2,1-2H3
InChIKey WBTQTPURGOVEMY-UHFFFAOYSA-N
Mol Weight 336.39 g/mol
Molecular Formula C20H20N2O3
Exact Mass 336.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4FUL3ee6Fc
Name Phenylbutazone-M (oxo-) ME @
Classification Analgesic Antiphlogistic
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Exact Mass 336.147392509 u
Formula C20H20N2O3
InChI InChI=1S/C20H20N2O3/c1-15(23)13-14-18-19(24)21(16-9-5-3-6-10-16)22(20(18)25-2)17-11-7-4-8-12-17/h3-12H,13-14H2,1-2H3
InChIKey WBTQTPURGOVEMY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 336.391 g/mol
SMILES COC=1N(c2ccccc2)N(C(=O)C1CCC(C)=O)c1ccccc1
SPLASH splash10-00nr-7944000000-3a80da66be660a5de659
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: P UME
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Suxibuzone-M/artifact (oxo-phenylbutazone) ME
Technique GC/MS
Wiley ID MMPW6e_6384