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Gabapentin MS3_1
SpectraBase Compound ID DRLVc2Ebh2h
InChI InChI=1S/C9H13O/c1-9(7-8-10)5-3-2-4-6-9/h7H,1-6H2/q+1
InChIKey LLDJGJMZCHZJCX-UHFFFAOYSA-N
Mol Weight 137.2 g/mol
Molecular Formula C9H13O
Exact Mass 137.09664 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 1Fl9h2B13F4
Name Gabapentin MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-150.00]
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InChI InChI=1S/C9H13O/c1-9(7-8-10)5-3-2-4-6-9/h7H,1-6H2/q+1
InChIKey LLDJGJMZCHZJCX-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES C(=C=O)C1(CCCCC1)[CH2+]
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