| SpectraBase Spectrum ID |
1NzaapYOpc |
| Name |
Californine-M isomer-2 2AC |
| Classification |
Alkaloid |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
411.168187523 u |
| Formula |
C23H25NO6 |
| InChI |
InChI=1S/C23H25NO6/c1-12(25)29-22-9-15-7-19-17-11-23(30-13(2)26)20(27-4)8-14(17)6-18(24(19)3)16(15)10-21(22)28-5/h8-11,18-19H,6-7H2,1-5H3 |
| InChIKey |
BNWRIWAZUXHMOS-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
411.454 g/mol |
| SMILES |
c1(c(OC(C)=O)cc2C3N(C(Cc2c1)c1cc(c(cc1C3)OC(=O)C)OC)C)OC |
| SPLASH |
splash10-001l-4951000000-9c4c879231c754205ab9 |
| 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 (bis-(demethylene-methyl-)) isomer-2 2AC |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_6730 |
