| SpectraBase Spectrum ID |
IwaTts3NEl |
| Name |
(4R,5R,7S,8R,9S,10S,11S)-7,8,9-Triacetyloxy-1-deuteriojiquilp-3(12)-ene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H29DO6 |
| InChI |
InChI=1S/C21H30O6/c1-10-8-14-9-15-16(10)21(14,7)19(27-13(4)24)17(25-11(2)22)18(20(15,5)6)26-12(3)23/h14-19H,1,8-9H2,2-7H3/t14-,15-,16-,17+,18+,19-,21+/m0/s1/i9D/t9-,14-,15-,16-,17+,18+,19-,21+ |
| InChIKey |
ZMESIASPXJCZQJ-HTKFLFHZSA-N |
| Instrument Name |
Hewlett-Packard 5989A or Hewlett Packard 5989B or Saturn 2000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np0201570 |
| Molecular Weight |
379.471 g/mol |
| SMILES |
[C@]12([C@]3(C([C@@]([C@]([C@@]([C@@]2([C@@](CC1=C)([C@@]3([D])[H])[H])C)(OC(=O)C)[H])(OC(C)=O)[H])(OC(C)=O)[H])(C)C)[H])[H] |
| SPLASH |
splash10-066u-4790000000-8ba3150025c0afb81f52 |
| Source of Spectrum |
G4-65-1545-15 |
| Wiley ID |
1883473 |
