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ISOPILOCARPINE
SpectraBase Compound ID ASPGHrYPIty
InChI InChI=1S/C11H16N2O2/c1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2/h5,7-8,10H,3-4,6H2,1-2H3
InChIKey QCHFTSOMWOSFHM-UHFFFAOYSA-N
Mol Weight 208.26 g/mol
Molecular Formula C11H16N2O2
Exact Mass 208.121178 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 8f1i7a515E
Name Pilocarpine MS2
CAS Registry Number 92-13-7
Comments F: ITMS + c ESI d w Full ms2 209.10
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Formula C11H16N2O2
InChI InChI=1S/C11H16N2O2/c1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2/h5,7-8,10H,3-4,6H2,1-2H3
InChIKey QCHFTSOMWOSFHM-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES CCC1C(OCC1CC=1N(C=NC1)C)=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 ms2
Technique ITMS