SpectraBase Spectrum ID |
IhWptNRu6t4 |
Name |
2-((2S,4aS,5R,7aR,11S,11aR,12aS,12bR)-2,5,8,12a-Tetramethyl-1,2,3,4,4a,5,6,7,7a,9,10,11,11a,12,12a,12b-hexadecahydrodibenzo[a,e]azulen-11-yl)propan-2-ol |
Appearance |
Colourless oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C25H42O |
InChI |
InChI=1S/C25H42O/c1-15-7-10-18-16(2)8-12-21-23-17(3)9-11-20(24(4,5)26)19(23)14-25(21,6)22(18)13-15/h15-16,18-22,26H,7-14H2,1-6H3/t15-,16+,18-,19+,20+,21-,22+,25+/m0/s1 |
InChIKey |
XGSASURBHJSQQZ-AKRSRPNCSA-N |
Instrument Name |
Agilent 7890B-5977A |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/anie.201812216 |
Molecular Weight |
358.610 g/mol |
Optical Rotation |
[a]D25 = +31 (c = 0.08, C6D6) |
SMILES |
OC([C@]1([C@]2(C[C@]3([C@@]4(C[C@](CC[C@]4([C@@](CC[C@]3(C2=C(CC1)C)[H])(C)[H])[H])(C)[H])[H])C)[H])[H])(C)C |
SPLASH |
splash10-0006-3958000000-a16a38032edcf9c0ea22 |
Source of Spectrum |
ACI-58-SM101-9 |
Thin-Layer Chromatography |
Rf = 0.78 (cyclohexane/EtOAc, 2:1) |
Wiley ID |
1840418 |