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5-F-MDMB-PINACA-M (defluoro-HO-) MS3_1
SpectraBase Compound ID DecaM1q7Ffd
InChI InChI=1S/C19H25N3O3/c1-19(2,3)16(13-24)20-18(25)17-14-9-5-6-10-15(14)22(21-17)11-7-4-8-12-23/h5-6,9-10,16,23H,4,7-8,11-12H2,1-3H3/p+1
InChIKey PYZCLDUXBUCNIY-UHFFFAOYSA-O
Mol Weight 344.44 g/mol
Molecular Formula C19H26N3O3
Exact Mass 344.197417 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 8usNDafl6Ct
Name 5-F-ADB-PINACA-M (defluoro-HO-) MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [80.00-355.00]
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Formula C19H26N3O3
InChI InChI=1S/C19H25N3O3/c1-19(2,3)16(13-24)20-18(25)17-14-9-5-6-10-15(14)22(21-17)11-7-4-8-12-23/h5-6,9-10,16,23H,4,7-8,11-12H2,1-3H3/p+1
InChIKey PYZCLDUXBUCNIY-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES N(C(C=1C2=CC=CC=C2N(CCCCCO)N1)=O)C([C+]=O)C(C)(C)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: Metabolite
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms3
Technique ITMS