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5-F-AB-PINACA artifact (deamino-) MS2
SpectraBase Compound ID EhfYb0DCL7t
InChI InChI=1S/C18H22FN3O2/c1-13(2)15(12-23)20-18(24)17-14-8-4-5-9-16(14)22(21-17)11-7-3-6-10-19/h4-5,8-9,13,15H,3,6-7,10-11H2,1-2H3/p+1
InChIKey BGSWUYKZIRISJA-UHFFFAOYSA-O
Mol Weight 332.4 g/mol
Molecular Formula C18H23FN3O2
Exact Mass 332.17743 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID L9YsmTj08xR
Name 5-F-AMP MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [80.00-345.00]
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Formula C18H23FN3O2
InChI InChI=1S/C18H22FN3O2/c1-13(2)15(12-23)20-18(24)17-14-8-4-5-9-16(14)22(21-17)11-7-3-6-10-19/h4-5,8-9,13,15H,3,6-7,10-11H2,1-2H3/p+1
InChIKey BGSWUYKZIRISJA-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES N(C([C+]=O)C(C)C)C(C1=NN(C2=C1C=CC=C2)CCCCCF)=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: Parent
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms3
Technique ITMS