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Oxyphenbutazone 2ME
SpectraBase Compound ID CPQimnkuPTi
InChI InChI=1S/C21H24N2O3/c1-4-5-11-19-20(24)22(16-9-7-6-8-10-16)23(21(19)26-3)17-12-14-18(25-2)15-13-17/h6-10,12-15H,4-5,11H2,1-3H3
InChIKey BAMWJBYBAKIYSU-UHFFFAOYSA-N
Mol Weight 352.43 g/mol
Molecular Formula C21H24N2O3
Exact Mass 352.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID PZb5BGV96
Name Oxyphenbutazone isomer-2 2ME @
Classification Antiphlogistic
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Exact Mass 352.178692638 u
Formula C21H24N2O3
InChI InChI=1S/C21H24N2O3/c1-4-5-11-19-20(24)22(16-9-7-6-8-10-16)23(21(19)26-3)17-12-14-18(25-2)15-13-17/h6-10,12-15H,4-5,11H2,1-3H3
InChIKey BAMWJBYBAKIYSU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 352.434 g/mol
SMILES COC1=C(C(N(N1c1ccc(cc1)OC)c1ccccc1)=O)CCCC
SPLASH splash10-0ufr-4924000000-0236e1b141acc614f17a
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.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Phenylbutazone-M (HO-) isomer-2 2ME
Technique GC/MS
Wiley ID MMPW6e_1507