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Protopine-M (N-oxide) MS2
SpectraBase Compound ID 53kX70qpTIj
InChI InChI=1S/C20H20NO6/c1-21(23)5-4-13-7-18-19(26-10-25-18)8-14(13)16(22)6-12-2-3-17-20(15(12)9-21)27-11-24-17/h2-3,7-8,23H,4-6,9-11H2,1H3/q+1
InChIKey UURHMTWNLWVKRF-UHFFFAOYSA-N
Mol Weight 370.38 g/mol
Molecular Formula C20H20NO6
Exact Mass 370.129062 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 63bFAixV0Rx
Name Protopine-M (N-oxide) MS2
Comments F: ITMS + c ESI d w Full ms2 370.10
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Formula C20H20NO6
InChI InChI=1S/C20H20NO6/c1-21(23)5-4-13-7-18-19(26-10-25-18)8-14(13)16(22)6-12-2-3-17-20(15(12)9-21)27-11-24-17/h2-3,7-8,23H,4-6,9-11H2,1H3/q+1
InChIKey UURHMTWNLWVKRF-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES O[N+]1(CCC=2C(C(CC3=C(C1)C1=C(OCO1)C=C3)=O)=CC=1OCOC1C2)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 ms2
Technique ITMS