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Mesembranol AC
SpectraBase Compound ID AvQpRjAAIoD
InChI InChI=1S/C19H27NO4/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/h5-6,11,15,18H,7-10,12H2,1-4H3
InChIKey CMFZAGGEHOQTNQ-UHFFFAOYSA-N
Mol Weight 333.43 g/mol
Molecular Formula C19H27NO4
Exact Mass 333.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6z2axikQVRv
Name Mesembranol AC
Classification Alkaloid
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Exact Mass 333.194008349 u
Formula C19H27NO4
InChI InChI=1S/C19H27NO4/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/h5-6,11,15,18H,7-10,12H2,1-4H3
InChIKey CMFZAGGEHOQTNQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 333.428 g/mol
SMILES C1C2N(C)CCC2(c2cc(c(cc2)OC)OC)CCC1OC(=O)C
SPLASH splash10-00xr-2491000000-6ecf07286c7680952be4
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.
Sample Preparation Procedure Detected: UGLUCSPE
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Mesembrine-M (dihydro-) AC
Technique GC/MS
Wiley ID MMPW6e_9001