pyrrolizidine](/api/spectrum/5ci8BMEPFkq/structure.png?h=300&w=458 "2,7-Dioxo-3-ethylidene-5-(hydroxymethyl)-6-methyl-5,6-epoxy-1,8-dioxadodeca[g,h](dihydro)pyrrolizidine")
| SpectraBase Compound ID | 8BQODpUkUw1 |
|---|---|
| InChI | 1S/C18H25NO6/c1-3-12-8-11(2)18(23,10-20)17(22)24-9-13-4-6-19-7-5-14(15(13)19)25-16(12)21/h3-4,11,14-15,20,23H,5-10H2,1-2H3/b12-3-/t11-,14-,15-,18-/m1/s1 |
| InChIKey | BCJMNZRQJAVDLD-CQRYIUNCSA-N |
| Mol Weight | 351.4 g/mol |
| Molecular Formula | C18H25NO6 |
| Exact Mass | 351.168188 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5ci8BMEPFkq |
|---|---|
| Name | Retrorsine |
| Appearance | White solid |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H25NO6 |
| InChI | InChI=1S/C18H25NO6/c1-3-12-8-11(2)18(23,10-20)17(22)24-9-13-4-6-19-7-5-14(15(13)19)25-16(12)21/h3-4,11,14-15,20,23H,5-10H2,1-2H3/b12-3-/t11-,14-,15-,18-/m1/s1 |
| InChIKey | BCJMNZRQJAVDLD-CQRYIUNCSA-N |
| Instrument Name | Hewlett-Packard 5890 |
| Ionization Type | EI |
| Literature Reference DOI | 10.3998/ark.5550190.0007.303 |
| Molecular Weight | 351.399 g/mol |
| SMILES | O[C@@]1(CO)C(OCC2=CCN3[C@]2([C@@](CC3)(OC(\C(C[C@]1(C)[H])=C/C)=O)[H])[H])=O |
| SPLASH | splash10-0079-0900000000-c7c23079543f26dfe522 |
| Source of Spectrum | ARK-2006-39-2 |
| Thin-Layer Chromatography | Rf = 0.22 |
| Wiley ID | 1871260 |