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Aminophenazone
SpectraBase Compound ID 5LjLCgU9QUC
InChI InChI=1S/C13H17N3O/c1-10-12(14(2)3)13(17)16(15(10)4)11-8-6-5-7-9-11/h5-9H,1-4H3
InChIKey RMMXTBMQSGEXHJ-UHFFFAOYSA-N
Mol Weight 231.3 g/mol
Molecular Formula C13H17N3O
Exact Mass 231.137162 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CbbB81we0oH
Name Aminophenazone @
CAS Registry Number 58-15-1
Classification Analgesic
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Exact Mass 231.137162178 u
Formula C13H17N3O
InChI InChI=1S/C13H17N3O/c1-10-12(14(2)3)13(17)16(15(10)4)11-8-6-5-7-9-11/h5-9H,1-4H3
InChIKey RMMXTBMQSGEXHJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 231.299 g/mol
SMILES C1(=O)N(N(C)C(=C1N(C)C)C)c1ccccc1
SPLASH splash10-0a4j-9210000000-f46086acdeb4a5b5d089
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 G U-I
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Dipyrone-M (dealkyl-) ME artifact Metamizol-M (dealkyl-) ME artifact
Technique GC/MS
Wiley ID MMPW6e_189