| SpectraBase Compound ID | IbuXUJHwsTJ |
|---|---|
| InChI | InChI=1S/C30H46O3/c1-27(31)33-29-23-19-25-30(32,26-29)24-18-13-11-9-7-5-3-2-4-6-8-10-12-15-20-28-21-16-14-17-22-28/h8,10,14,16-17,19,21-23,29,32H,2-7,9,11-13,15,18,20,24-26H2,1H3/b10-8-/t29-,30+/m0/s1 |
| InChIKey | QBBFZPRUEILJGI-BIMGULASSA-N |
| Mol Weight | 454.7 g/mol |
| Molecular Formula | C30H46O3 |
| Exact Mass | 454.344695 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | FSeruOp9KVJ |
|---|---|
| Name | 1-(16'-PHENYL-12'Z-HEXADECENYL)-3S*-ACETYL-4-CYCLOHEXEN-1S*-OL |
| Compound Number | 4A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O3 |
| InChI | InChI=1S/C30H46O3/c1-27(31)33-29-23-19-25-30(32,26-29)24-18-13-11-9-7-5-3-2-4-6-8-10-12-15-20-28-21-16-14-17-22-28/h8,10,14,16-17,19,21-23,29,32H,2-7,9,11-13,15,18,20,24-26H2,1H3/b10-8-/t29-,30+/m0/s1 |
| InChIKey | QBBFZPRUEILJGI-BIMGULASSA-N |
| Literature Reference Author | S.D.J.CORREIRA,J.M.DAVID,J.P.DAVID,H.B.CHAI,J.M.PEZZUTO,G.A. CORDELL |
| Literature Reference Citation | PHYTOCHEM.,56,781(2001) |
| Literature Reference DOI | 10.1016/S0031-9422(00)00476-3 |
| Molecular Weight | 454.693 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN2045 |