| SpectraBase Compound ID | 9cqSHvriDkK |
|---|---|
| InChI | InChI=1S/C20H28O3/c1-6-12-11(2)15(21)9-14-13(12)7-8-17-19(3,4)18(23)16(22)10-20(14,17)5/h6,9,16-18,21-23H,1,7-8,10H2,2-5H3/t16-,17-,18-,20+/m1/s1 |
| InChIKey | RLJCBUKFIDXOQW-MLYOOKFZSA-N |
| Mol Weight | 316.44 g/mol |
| Molecular Formula | C20H28O3 |
| Exact Mass | 316.203845 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | BcaWP5GNAuc |
|---|---|
| Name | Cleistanthol |
| Appearance | White solid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H28O3 |
| InChI | InChI=1S/C20H28O3/c1-6-12-11(2)15(21)9-14-13(12)7-8-17-19(3,4)18(23)16(22)10-20(14,17)5/h6,9,16-18,21-23H,1,7-8,10H2,2-5H3/t16-,17-,18-,20+/m1/s1 |
| InChIKey | RLJCBUKFIDXOQW-MLYOOKFZSA-N |
| Instrument Name | Micromass VG 70-250S |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np010098a |
| Molecular Weight | 316.441 g/mol |
| Optical Rotation | [a]D = -60.0 (c = 0.05, CHCl3) |
| SMILES | O[C@@]1([C@@](C[C@@]2([C@](CCc3c2cc(c(c3C=C)C)O)(C1(C)C)[H])C)(O)[H])[H] |
| SPLASH | splash10-014i-0926000000-08a13141e5726caa6732 |
| Source of Spectrum | G4-64-SM2-2 |
| Wiley ID | 1883210 |