| SpectraBase Spectrum ID |
KLxXPHBLD4r |
| Name |
(4R,8R,9R)-8-Methoxyisocaryolane-9,15-diol |
| Appearance |
Oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H28O3 |
| InChI |
InChI=1S/C16H28O3/c1-14-6-5-13(18)16(9-14,19-3)7-4-11-12(14)8-15(11,2)10-17/h11-13,17-18H,4-10H2,1-3H3/t11-,12+,13-,14+,15+,16-/m1/s1 |
| InChIKey |
ZZSJBVDQTYEHSH-YUDUXTHKSA-N |
| Instrument Name |
Finnigan Voyager |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np1009465 |
| Molecular Weight |
268.397 g/mol |
| Optical Rotation |
[a]D25 =-5 (c = 0.22, CHCl3) |
| Reported Formula |
C16H28O3 |
| SMILES |
O[C@]1([C@@]2(C[C@@]([C@]3(C[C@@](CO)([C@@]3(CC2)[H])C)[H])(CC1)C)OC)[H] |
| SPLASH |
splash10-0a4i-1290000000-bb6e97b54b31021ad8d6 |
| Source of Spectrum |
G4-74-1711-6 |
| Wiley ID |
1849196 |
