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Yohimbine MS3_1
SpectraBase Compound ID 2NyJICM6dvf
InChI InChI=1S/C11H18NO3/c1-15-11(14)10-8-4-5-12-6-7(8)2-3-9(10)13/h5,7-10,12-13H,2-4,6H2,1H3/q+1
InChIKey ABEUKHWTFHVHBM-UHFFFAOYSA-N
Mol Weight 212.27 g/mol
Molecular Formula C11H18NO3
Exact Mass 212.128668 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 9KPfxtiJ16
Name Yohimbine MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-225.00]
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InChI InChI=1S/C11H18NO3/c1-15-11(14)10-8-4-5-12-6-7(8)2-3-9(10)13/h5,7-10,12-13H,2-4,6H2,1H3/q+1
InChIKey ABEUKHWTFHVHBM-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES N1CC2C(C(C(CC2)O)C(=O)OC)C[CH+]1
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