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Linezolide-M (PNU-173558) MS3_1
SpectraBase Compound ID J8rG2iztXlB
InChI InChI=1S/C12H14FN3O4/c13-9-3-7(1-2-10(9)15-5-11(17)18)16-6-8(4-14)20-12(16)19/h1-3,8,15H,4-6,14H2,(H,17,18)/p+1
InChIKey SZYBMTYGXCBLIJ-UHFFFAOYSA-O
Mol Weight 284.27 g/mol
Molecular Formula C12H15FN3O4
Exact Mass 284.104659 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID JrTpiL9XJVo
Name Linezolide-M (PNU-173558) MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [65.00-295.00]
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InChI InChI=1S/C12H14FN3O4/c13-9-3-7(1-2-10(9)15-5-11(17)18)16-6-8(4-14)20-12(16)19/h1-3,8,15H,4-6,14H2,(H,17,18)/p+1
InChIKey SZYBMTYGXCBLIJ-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES [NH3+]CC1CN(C2=CC=C(C(=C2)F)NCC(O)=O)C(O1)=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: Metabolite
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms3
Technique ITMS