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BDMPEA artifact (deamino-) MS2
SpectraBase Compound ID 6sHw57HuXP7
InChI InChI=1S/C10H12BrO2/c1-4-7-5-10(13-3)8(11)6-9(7)12-2/h5-6H,1,4H2,2-3H3/q+1
InChIKey SHDYZCMIYIFCHM-UHFFFAOYSA-N
Mol Weight 244.11 g/mol
Molecular Formula C10H12BrO2
Exact Mass 243.002068 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID G7rsww4fL4j
Name BDMPEA artifact (deamino-) isotope MS2
Comments F: ITMS + c ESI d w Full ms2 245.10
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InChI InChI=1S/C10H12BrO2/c1-4-7-5-10(13-3)8(11)6-9(7)12-2/h5-6H,1,4H2,2-3H3/q+1
InChIKey SHDYZCMIYIFCHM-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES [CH2+]CC1=CC(=C(C=C1OC)Br)OC
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