| SpectraBase Spectrum ID |
3eFdsrWQF1c |
| Name |
(4S,5R,10S)-(-)-methyl aignopsanoate A |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
264.172544630 u |
| Formula |
C16H24O3 |
| GC Column |
Optima delta (20 m x 0.25 mm) |
| InChI |
InChI=1S/C16H24O3/c1-11-6-5-8-16(3)14(18)12(10-13(17)19-4)7-9-15(11,16)2/h10-11H,5-9H2,1-4H3/b12-10-/t11-,15+,16+/m0/s1 |
| InChIKey |
CJQOKVDQHHONIF-USYVDOKNSA-N |
| Instrument Name |
Finnigan trace GC-MS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201404766 |
| Molecular Weight |
264.365 g/mol |
| Optical Rotation |
[a]D20 = -62.3 (c = 0.01, MeOH) |
| Quality |
362 |
| SMILES |
C1CC[C@@]([C@]2(CC\C(C([C@@]12C)=O)=C\C(OC)=O)C)(C)[H] |
| SPLASH |
splash10-004i-6900000000-7384ca652e8e7653eb3a |
| Source of Spectrum |
QE-21-400-2 (DOI: 10.1002/chem.201404766) |
| Wiley ID |
1906271 |
