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Piperacilline MS3_1
SpectraBase Compound ID ID0kqoA3S2r
InChI InChI=1S/C17H18N4O5/c1-2-20-9-10-21(16(25)15(20)24)17(26)19-13(14(23)18-8-11-22)12-6-4-3-5-7-12/h3-8,13H,2,9-10H2,1H3,(H2-,18,19,22,23,24,25,26)/p+1
InChIKey FOANUSUOFQQFSJ-UHFFFAOYSA-O
Mol Weight 359.36 g/mol
Molecular Formula C17H19N4O5
Exact Mass 359.135545 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID FH900FlhmaW
Name Piperacilline MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [85.00-370.00]
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InChI InChI=1S/C17H18N4O5/c1-2-20-9-10-21(16(25)15(20)24)17(26)19-13(14(23)18-8-11-22)12-6-4-3-5-7-12/h3-8,13H,2,9-10H2,1H3,(H2-,18,19,22,23,24,25,26)/p+1
InChIKey FOANUSUOFQQFSJ-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES N(C=[C+]O)C(C(NC(N1CCN(C(C1=O)=O)CC)=O)C1=CC=CC=C1)=O
Sample Comments The MWW Reference Handbook and associated table are attached to Record #1, under the Attachments tab. Refer to these references for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database.
Sample Description Analyte Type: Parent
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms3
Technique ITMS