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Mesembrenone AC
SpectraBase Compound ID BcGzlEbABQA
InChI InChI=1S/C19H23NO4/c1-13(21)24-15-7-8-19(9-10-20(2)18(19)12-15)14-5-6-16(22-3)17(11-14)23-4/h5-8,11-12,18H,9-10H2,1-4H3
InChIKey TXLRYDZTLDOCPM-UHFFFAOYSA-N
Mol Weight 329.4 g/mol
Molecular Formula C19H23NO4
Exact Mass 329.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8PdjN4a9xAn
Name Mesembrenone AC
Classification Alkaloid Drug of abuse
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Exact Mass 329.162708221 u
Formula C19H23NO4
InChI InChI=1S/C19H23NO4/c1-13(21)24-15-7-8-19(9-10-20(2)18(19)12-15)14-5-6-16(22-3)17(11-14)23-4/h5-8,11-12,18H,9-10H2,1-4H3
InChIKey TXLRYDZTLDOCPM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 329.396 g/mol
SMILES C=1C2N(C)CCC2(c2cc(c(cc2)OC)OC)C=CC1OC(=O)C
SPLASH splash10-0kdi-4960000000-62b0e1601c02889f5197
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_8997