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8-OXYBERBERINE
SpectraBase Compound ID BcmKcIreC6y
InChI InChI=1S/C20H17NO5/c1-23-15-4-3-12-7-14-13-9-17-16(25-10-26-17)8-11(13)5-6-21(14)20(22)18(12)19(15)24-2/h3-4,7-9H,5-6,10H2,1-2H3
InChIKey ZHYQCBCBTQWPLC-UHFFFAOYSA-N
Mol Weight 351.36 g/mol
Molecular Formula C20H17NO5
Exact Mass 351.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2HKYMoshPM
Name Oxyberberine
CAS Registry Number 549-21-3
Classification Alkaloid
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Exact Mass 351.110672646 u
Formula C20H17NO5
InChI InChI=1S/C20H17NO5/c1-23-15-4-3-12-7-14-13-9-17-16(25-10-26-17)8-11(13)5-6-21(14)20(22)18(12)19(15)24-2/h3-4,7-9H,5-6,10H2,1-2H3
InChIKey ZHYQCBCBTQWPLC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 351.358 g/mol
SMILES COc1c(c2C(N3C(=Cc2cc1)c1cc2OCOc2cc1CC3)=O)OC
SPLASH splash10-0udr-1239000000-fbf6356d8e1c72507186
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_5661