| SpectraBase Compound ID | 6rPLcjsVnd8 |
|---|---|
| InChI | InChI=1S/C18H23NO6/c1-10-8-18(11(2)25-18)16(21)24-13-5-7-19-6-4-12(14(13)19)9-23-15(20)17(10,3)22/h4,11,13-14,22H,1,5-9H2,2-3H3 |
| InChIKey | XCEPKQNOWNOSFH-UHFFFAOYSA-N |
| Mol Weight | 349.38 g/mol |
| Molecular Formula | C18H23NO6 |
| Exact Mass | 349.152537 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JdRNYMebU2H |
|---|---|
| Name | Jacozine |
| CAS Registry Number | 5532-23-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H23NO6 |
| InChI | InChI=1S/C18H23NO6/c1-10-8-18(11(2)25-18)16(21)24-13-5-7-19-6-4-12(14(13)19)9-23-15(20)17(10,3)22/h4,11,13-14,22H,1,5-9H2,2-3H3 |
| InChIKey | XCEPKQNOWNOSFH-UHFFFAOYSA-N |
| Molecular Weight | 349.383 g/mol |
| SMILES | OC1(C(CC2(C(OC3CCN4C3C(COC1=O)=CC4)=O)C(C)O2)=C)C |
| SPLASH | splash10-00r6-8900000000-67aaf06d53a9deaaae51 |
| Source of Spectrum | W5-1989-38162-27374 |
| Synonyms | Senecionan-11,16-dione, 13,19-didehydro-15,20-epoxy-15,20-dihydro-12-hydroxy-, (15alpha,20S)- Spiro((1,6)dioxacyclododecino(2,3,4-gh)pyrrolizine-3(2H),2'-oxirane)-2,7(4H)-dione, 5,6,9,11,13,14,14a,14b-octahydro-6-hydroxy-3',6-dimethyl-5-methylene-, (3S,3'S,6R,14aR,14bR)- |
| Wiley ID | 1341331 |