| SpectraBase Spectrum ID |
B4IN3TVzkAq |
| Name |
Ethyl 17-Norabiet-13(15)-E-en-8.beta.-ol-16-oate |
| Appearance |
White crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H34O3 |
| InChI |
InChI=1S/C21H34O3/c1-5-24-18(22)13-15-7-8-17-20(4)11-6-10-19(2,3)16(20)9-12-21(17,23)14-15/h13,16-17,23H,5-12,14H2,1-4H3/b15-13+/t16-,17-,20+,21-/m1/s1 |
| InChIKey |
OGZWWKHOWAJYEN-OBPDKVQSSA-N |
| Instrument Name |
Finnegan-Matt GCQ |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np0701071 |
| Molecular Weight |
334.500 g/mol |
| Optical Rotation |
[a]D34 = -68.1 (c = 1.8, CHCl3) |
| Reported Formula |
C21H34O3 |
| SMILES |
O[C@@]12CC[C@]3([C@](CCCC3(C)C)([C@]1(CC\C(C2)=C/C(OCC)=O)[H])C)[H] |
| SPLASH |
splash10-06di-0279000000-1f008e6522e3af8dc901 |
| Source of Spectrum |
G4-70-1257-6 |
| Wiley ID |
1874599 |
