| SpectraBase Spectrum ID |
4VRS1rq0pt9 |
| Name |
(4R,6S,6aR,9S)-3,6,9-trimethyl-4-(2-methylprop-1-enyl)-5,6,6a,7,8,9-hexahydro-4H-phenalene-1,2-diol |
| Appearance |
Colorless oil |
| Carrier Gas |
Hydrogen (1.7 ml/min, 1.2 bar) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
300.208930140 u |
| Formula |
C20H28O2 |
| GC Column |
Optima-1-MS (30 m x 0.25 mm) |
| GC Oven Program |
Oven temp 300oC |
| InChI |
InChI=1S/C20H28O2/c1-10(2)8-14-9-12(4)15-7-6-11(3)16-18(15)17(14)13(5)19(21)20(16)22/h8,11-12,14-15,21-22H,6-7,9H2,1-5H3/t11-,12-,14-,15+/m0/s1 |
| InChIKey |
QYYIMVMYWAMAAS-NZBPQXDJSA-N |
| Instrument Name |
Agilent GC6890-HP 5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202101863 |
| Molecular Weight |
300.442 g/mol |
| Quality |
362 |
| SMILES |
OC=1C(=C2C3=C(C1O)[C@](CC[C@@]3([C@](C[C@@]2(C=C(C)C)[H])(C)[H])[H])(C)[H])C |
| SPLASH |
splash10-0udr-1193000000-850ca4bff2e34ceb9460 |
| Source of Spectrum |
QE-27-SM34-20 (DOI: 10.1002/chem.202101863) |
| Thin-Layer Chromatography |
0.43 (CyHex/EtOAc, 5:1) |
| Wiley ID |
1902163 |
![(1R,3S,6S,13R)-7,8-Dihydroxy-1-(2-methylprop-1-enyl)-3,6,9-trimethyl-2,3,3a,4,5-hexahydro-1H-phenalene [pseudopterosins- A-F-aglycone]](/api/spectrum/4VRS1rq0pt9/structure.png?h=300&w=458 "(1R,3S,6S,13R)-7,8-Dihydroxy-1-(2-methylprop-1-enyl)-3,6,9-trimethyl-2,3,3a,4,5-hexahydro-1H-phenalene [pseudopterosins- A-F-aglycone]")
