| SpectraBase Compound ID | D2KvUutPd3h |
|---|---|
| InChI | InChI=1S/C22H40O3/c1-16(11-15-25-18(3)23)9-13-20(4)17(2)10-14-21(5)19(20)8-7-12-22(21,6)24/h16-17,19,24H,7-15H2,1-6H3/t16?,17-,19?,20+,21-,22-/m1/s1 |
| InChIKey | LMZAFQUVULHJSK-AGFNQYKUSA-N |
| Mol Weight | 352.6 g/mol |
| Molecular Formula | C22H40O3 |
| Exact Mass | 352.297745 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 | 58zSct02PNu |
|---|---|
| Name | 15-Acetoxy-neoclerodan-4.alpha.-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H40O3 |
| InChI | InChI=1S/C22H40O3/c1-16(11-15-25-18(3)23)9-13-20(4)17(2)10-14-21(5)19(20)8-7-12-22(21,6)24/h16-17,19,24H,7-15H2,1-6H3/t16?,17-,19?,20+,21-,22-/m1/s1 |
| InChIKey | LMZAFQUVULHJSK-AGFNQYKUSA-N |
| Molecular Weight | 352.559 g/mol |
| SMILES | O[C@]1([C@]2(C([C@](CCC(CCOC(=O)C)C)(C)[C@@](CC2)(C)[H])CCC1)C)C |
| SPLASH | splash10-0a4l-9832000000-5af79f678b7815208883 |
| Source of Spectrum | F-50-10801-21 |
| Wiley ID | 789404 |