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Physostigmine-M (nor-) MS3_1
SpectraBase Compound ID ESeGCBq6DqP
InChI InChI=1S/C14H19N3O2/c1-14-6-7-16-12(14)17(3)11-5-4-9(8-10(11)14)19-13(18)15-2/h4-5,8,12,16H,6-7H2,1-3H3,(H,15,18)
InChIKey DWMBEPKCENULIA-UHFFFAOYSA-N
Mol Weight 261.32 g/mol
Molecular Formula C14H19N3O2
Exact Mass 261.147727 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 51Ghi9IFZij
Name Physostigmine-M (nor-) MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-215.00]
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InChI InChI=1S/C14H19N3O2/c1-14-6-7-16-12(14)17(3)11-5-4-9(8-10(11)14)19-13(18)15-2/h4-5,8,12,16H,6-7H2,1-3H3,(H,15,18)
InChIKey DWMBEPKCENULIA-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES N(C)C(OC=1C=C2C3(CCNC3N(C2=CC1)C)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: Metabolite
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms3
Technique ITMS