| SpectraBase Spectrum ID |
G3O5abRvQVB |
| Name |
3.alpha.-(1-Methylitaconyl)-6.beta.-senecioyloxytropane |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H27NO6 |
| InChI |
InChI=1S/C19H27NO6/c1-11(2)6-17(21)26-16-9-13-8-14(10-15(16)20(13)4)25-18(22)7-12(3)19(23)24-5/h6,13-16H,3,7-10H2,1-2,4-5H3/t13-,14-,15+,16-/m1/s1 |
| InChIKey |
SVGZLNFUGDVZCD-LVQVYYBASA-N |
| Instrument Name |
Hewlett-Packard chromatograph 5890 series II or Hewlett-Packard 5972 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np900780w |
| Molecular Weight |
365.426 g/mol |
| Optical Rotation |
[a]D22 = -10 (MeOH, c 0.1) |
| Reported Formula |
C19H29NO6 |
| SMILES |
C1[C@](C[C@]2([C@@](C[C@@]1(N2C)[H])(OC(C=C(C)C)=O)[H])[H])(OC(CC(C(=O)OC)=C)=O)[H] |
| SPLASH |
splash10-006x-9420000000-8a2d021b9a4150125b66 |
| Source of Spectrum |
G4-73-847-1 |
| Wiley ID |
1846436 |
