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Oxyphenbutazone AC
SpectraBase Compound ID Ae4s4KY6azV
InChI InChI=1S/C21H22N2O4/c1-3-4-10-19-20(25)22(16-8-6-5-7-9-16)23(21(19)26)17-11-13-18(14-12-17)27-15(2)24/h5-9,11-14,19H,3-4,10H2,1-2H3
InChIKey OFWIUVGFAFHEIF-UHFFFAOYSA-N
Mol Weight 366.42 g/mol
Molecular Formula C21H22N2O4
Exact Mass 366.157957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7TJWtxk8hTL
Name Oxyphenbutazone AC @
Classification Antiphlogistic
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Exact Mass 366.157957192 u
Formula C21H22N2O4
InChI InChI=1S/C21H22N2O4/c1-3-4-10-19-20(25)22(16-8-6-5-7-9-16)23(21(19)26)17-11-13-18(14-12-17)27-15(2)24/h5-9,11-14,19H,3-4,10H2,1-2H3
InChIKey OFWIUVGFAFHEIF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 366.417 g/mol
SMILES CC(Oc1ccc(cc1)N1N(C(C(CCCC)C1=O)=O)c1ccccc1)=O
SPLASH splash10-05vn-9712000000-d61c0ceae39de7bb6cfd
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: U+UHYAC
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Phenylbutazone-M (HO-) AC
Technique GC/MS
Wiley ID MMPW6e_1506