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Linezolide-M (PNU-142618) MS2
SpectraBase Compound ID JE9AMSxV90R
InChI InChI=1S/C14H18FN3O4/c1-9(20)17-7-11-8-18(14(21)22-11)10-2-3-13(12(15)6-10)16-4-5-19/h2-3,6,11,16,19H,4-5,7-8H2,1H3,(H,17,20)
InChIKey FPAKSIHCULOSLI-UHFFFAOYSA-N
Mol Weight 311.31 g/mol
Molecular Formula C14H18FN3O4
Exact Mass 311.128134 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 9pDCYADiBk
Name Linezolide-M (PNU-142618) MS2
Comments F: ITMS + c ESI d w Full ms2 312.10
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Formula C14H18FN3O4
InChI InChI=1S/C14H18FN3O4/c1-9(20)17-7-11-8-18(14(21)22-11)10-2-3-13(12(15)6-10)16-4-5-19/h2-3,6,11,16,19H,4-5,7-8H2,1H3,(H,17,20)
InChIKey FPAKSIHCULOSLI-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES N(CCO)C1=CC=C(N2C(OC(CNC(=O)C)C2)=O)C=C1F
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: Metabolite
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms2
Technique ITMS