| SpectraBase Spectrum ID |
4bdfPdhBztK |
| Name |
Demethylmesembranol isomer-3 2AC @ |
| Classification |
Alkaloid |
| Copyright |
Copyright © 2023-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
361.188922968 u |
| Formula |
C20H27NO5 |
| InChI |
InChI=1S/C20H27NO5/c1-13(22)25-16-7-8-20(9-10-21(3)19(20)12-16)15-5-6-17(24-4)18(11-15)26-14(2)23/h5-6,11,16,19H,7-10,12H2,1-4H3 |
| InChIKey |
IWCPNHZSZZQVKT-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
361.438 g/mol |
| SMILES |
C1C2N(C)CCC2(CCC1OC(=O)C)c1ccc(c(c1)OC(=O)C)OC |
| SPLASH |
splash10-03di-2962000000-65906c7b1a3125f478ff |
| 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 (demethyl-dihydro-) isomer-3 2AC |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_9003 |
