| SpectraBase Spectrum ID |
1weQn9OSDw |
| Name |
Dolabellanone 3 |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H32O3 |
| InChI |
InChI=1S/C22H32O3/c1-14(2)21-18-11-10-15(3)8-7-9-16(4)20(25-17(5)23)13-22(18,6)12-19(21)24/h8,18,20H,4,7,9-13H2,1-3,5-6H3/b15-8+/t18-,20+,22+/m1/s1 |
| InChIKey |
WYZJBWCWBBQHFF-YLKJAGNESA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np100074r |
| Molecular Weight |
344.495 g/mol |
| Optical Rotation |
[a]D25 = +5.7 (c = 1.3, CHCl3) |
| Reported Formula |
C22H32O3 |
| SMILES |
C1\C=C\(CC[C@]2([C@](C[C@@](C(C1)=C)(OC(C)=O)[H])(CC(C2=C(C)C)=O)C)[H])C |
| SPLASH |
splash10-0ffc-7950000000-c3b1645fc1b96ed77ada |
| Source of Spectrum |
G4-73-932-3 |
| Wiley ID |
1848967 |
