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DFMBDB MS2
SpectraBase Compound ID 4mVVaSyCBwg
InChI InChI=1S/C12H15F2NO2/c1-3-9(15-2)7-8-5-4-6-10-11(8)17-12(13,14)16-10/h4-6,9,15H,3,7H2,1-2H3
InChIKey OLBFCKXBVFGHSC-UHFFFAOYSA-N
Mol Weight 243.25 g/mol
Molecular Formula C12H15F2NO2
Exact Mass 243.107085 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 7fZL4GqqdCr
Name DFMBDB MS2
Comments F: ITMS + c ESI d w Full ms2 244.10
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Formula C12H15F2NO2
InChI InChI=1S/C12H15F2NO2/c1-3-9(15-2)7-8-5-4-6-10-11(8)17-12(13,14)16-10/h4-6,9,15H,3,7H2,1-2H3
InChIKey OLBFCKXBVFGHSC-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES N(C(CC1=CC=CC2=C1OC(O2)(F)F)CC)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 ms2
Technique ITMS