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Fenfluramine MS3_1
SpectraBase Compound ID 7rkd37PUuqN
InChI InChI=1S/C10H10F3/c1-2-4-8-5-3-6-9(7-8)10(11,12)13/h2-3,5-7H,4H2,1H3/q+1
InChIKey XNDOFDJMIGAGJP-UHFFFAOYSA-N
Mol Weight 187.19 g/mol
Molecular Formula C10H10F3
Exact Mass 187.07346 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 5fLT8pv3KAd
Name Dexfenfluramine MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-200.00]
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InChI InChI=1S/C10H10F3/c1-2-4-8-5-3-6-9(7-8)10(11,12)13/h2-3,5-7H,4H2,1H3/q+1
InChIKey XNDOFDJMIGAGJP-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES [CH+](CC1=CC=CC(=C1)C(F)(F)F)C
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