| SpectraBase Compound ID | BFoOd6hQt44 |
|---|---|
| InChI | InChI=1S/C13H21NO2/c1-11(8-10-16-12(2)15)6-7-13-5-3-4-9-14-13/h8H,3-7,9-10H2,1-2H3/b11-8+ |
| InChIKey | LCFPXTCFLVXEEG-DHZHZOJOSA-N |
| Mol Weight | 223.32 g/mol |
| Molecular Formula | C13H21NO2 |
| Exact Mass | 223.157229 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Dwib1fyZrdl |
|---|---|
| Name | Polonicumtoxin B |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H21NO2 |
| InChI | InChI=1S/C13H21NO2/c1-11(8-10-16-12(2)15)6-7-13-5-3-4-9-14-13/h8H,3-7,9-10H2,1-2H3/b11-8+ |
| InChIKey | LCFPXTCFLVXEEG-DHZHZOJOSA-N |
| Molecular Weight | 223.316 g/mol |
| SMILES | C1(=NCCCC1)CC\C(=C\COC(=O)C)C |
| SPLASH | splash10-03di-0900000000-4a804990bdaa804d0b10 |
| Source of Spectrum | H1-48-92-2 |
| Synonyms | (2E)-3-methyl-5-(3,4,5,6-tetrahydro-2-pyridinyl)-2-pentenyl acetate acetic acid[(E)-3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pent-2-enyl]ester [(E)-3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pent-2-enyl]acetate [(E)-3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pent-2-enyl]ethanoate [(E)-3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pent-2-enyl] acetate [(E)-3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pent-2-enyl] ethanoate |
| Wiley ID | 816249 |