| SpectraBase Spectrum ID |
B3i81PclXEG |
| Name |
(1S,2S)-2-(8-ethyl-3,12,16-trimethyl-heptadeca-3,7,11,15-tetraenyl)-1,3,3-trimethyl-cyclohexanol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
442.417466358 u |
| Formula |
C31H54O |
| InChI |
InChI=1S/C31H54O/c1-9-28(20-13-18-26(4)17-12-15-25(2)3)19-11-10-16-27(5)21-22-29-30(6,7)23-14-24-31(29,8)32/h15-16,18-19,29,32H,9-14,17,20-24H2,1-8H3/t29-,31-/m0/s1 |
| InChIKey |
OALZTLYKNWMWKZ-SMCANUKXSA-N |
| Instrument Name |
JEOL SX 100/JMS-Q1000 GC K9 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201800010 |
| Molecular Weight |
442.772 g/mol |
| Optical Rotation |
[a]D25 = +46 (c = 0.02, CHCl3) |
| Quality |
606 |
| Reported Formula |
C31H52 |
| SMILES |
O[C@]1(CCCC([C@@]1(CCC(C)=CCCC=C(CCC=C(CCC=C(C)C)C)CC)[H])(C)C)C |
| SPLASH |
splash10-01bj-9701100000-02c75daf4da9fa137957 |
| Source of Spectrum |
K1-2018-SM63-41 (DOI: 10.1002/ejoc.201800010) |
| Wiley ID |
1893947 |
