| SpectraBase Spectrum ID |
8o6lbnrACID |
| Name |
Cespitularin B |
| Appearance |
amorphous solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H28O |
| InChI |
InChI=1S/C20H28O/c1-14-6-5-7-15(2)12-18-19-16(13-21-18)9-11-17(10-8-14)20(19,3)4/h7,13,17H,1,5-6,8-12H2,2-4H3/b15-7+/t17-/m1/s1 |
| InChIKey |
MHENRDVDYDHIBZ-SXKJYUOZSA-N |
| Instrument Name |
JEOL JMS-SX/SX 102A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np020077w |
| Molecular Weight |
284.443 g/mol |
| Optical Rotation |
[a]D25 = -20.6 (c = 0.08, CHCl3) |
| Reported Formula |
C20H28O |
| SMILES |
C1Cc2c3C([C@@]1(CCC(CC\C=C\(Cc3oc2)C)=C)[H])(C)C |
| SPLASH |
splash10-0006-9570000000-877cffb494e2148c3bbc |
| Source of Spectrum |
G4-65-1433-2 |
| Wiley ID |
1883357 |
