| SpectraBase Spectrum ID |
CMmtmVKmMdg |
| Name |
Californine-M 2AC |
| Classification |
Alkaloid |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
395.136887394 u |
| Formula |
C22H21NO6 |
| InChI |
InChI=1S/C22H21NO6/c1-11(24)23-17-4-13-6-19(26-3)22(29-12(2)25)9-16(13)18(23)5-14-7-20-21(8-15(14)17)28-10-27-20/h6-9,17-18H,4-5,10H2,1-3H3/t17-,18-/m1/s1 |
| InChIKey |
NQGFGVBNUARVFM-QZTJIDSGSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
395.411 g/mol |
| SMILES |
c1(c(OC(C)=O)cc2[C@@]3(N([C@](Cc2c1)(c1cc2c(cc1C3)OCO2)[H])C(C)=O)[H])OC |
| SPLASH |
splash10-02or-2985000000-4483a302a6a4623f0350 |
| 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 |
| Synonyms |
Californine-M (nor-demethylene-methyl-) 2AC |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_6736 |
