| SpectraBase Compound ID | IholKAII3K0 |
|---|---|
| InChI | InChI=1S/C29H46O3/c1-19(6-5-7-20(2)27-31-16-17-32-27)24-10-11-25-23-9-8-21-18-22(30)12-14-28(21,3)26(23)13-15-29(24,25)4/h18-20,23-27H,5-17H2,1-4H3 |
| InChIKey | ACAAWTFOGIRPBM-UHFFFAOYSA-N |
| Mol Weight | 442.7 g/mol |
| Molecular Formula | C29H46O3 |
| Exact Mass | 442.344695 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 | 1Lx6gr15FpF |
|---|---|
| Name | Cholest-4-en-26-al, 3-oxo-, cyclic 26-(ethylene acetal) |
| Alternate Name(s) | 17-[5-(1,3-dioxolan-2-yl)-1-methyl-hexyl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one 17-[6-(1,3-dioxolan-2-yl)heptan-2-yl]-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one |
| CAS Registry Number | 23405-51-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H46O3 |
| InChI | InChI=1S/C29H46O3/c1-19(6-5-7-20(2)27-31-16-17-32-27)24-10-11-25-23-9-8-21-18-22(30)12-14-28(21,3)26(23)13-15-29(24,25)4/h18-20,23-27H,5-17H2,1-4H3 |
| InChIKey | ACAAWTFOGIRPBM-UHFFFAOYSA-N |
| Molecular Weight | 442.684 g/mol |
| SMILES | CC12C(C3C(CC2)C2(C)C(CC3)=CC(CC2)=O)CCC1C(CCCC(C)C1OCCO1)C |
| SPLASH | splash10-00di-8910100000-331edfac4cf5513a41c1 |
| Source of Spectrum | W-10-279-21 |
| Wiley ID | 60217 |