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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 Cydyign9nVG
Name Pilocarpine
CAS Registry Number 92-13-7
Collision Gas N2
Comments FTMS + p ESI d Full ms2 [email protected] [50.00-230.00]
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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
Inlet Type UHPLC
Instrument Name Thermo Fisher Q Exactive Orbitrap
Ion Polarity P
Ionization Type HESI
Precursor Ion [M+H]+
SMILES CCC1C(OCC1CC=1N(C=NC1)C)=O
Sample Comments The MMHW Reference Handbook is attached to Record #1, under the Attachments tab. Refer to this reference for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database.
Selected Ion Charge 1
Source of Spectrum Maurer/Meyer/Helfer/Weber c/o Saarland University Homburg/Saar
Spectrum Type ms2
Technique HCD