| SpectraBase Compound ID | GHjDFFXc8x |
|---|---|
| InChI | InChI=1S/C30H50O/c1-20-21(31)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h20,22-24H,9-19H2,1-8H3 |
| InChIKey | OFMXGFHWLZPCFL-UHFFFAOYSA-N |
| Mol Weight | 426.7 g/mol |
| Molecular Formula | C30H50O |
| Exact Mass | 426.386166 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Bg7ZiJVd5bK |
|---|---|
| Name | D:A-Friedooleanan-3-one |
| CAS Registry Number | 559-74-0 |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H50O |
| InChI | InChI=1S/C30H50O/c1-20-21(31)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h20,22-24H,9-19H2,1-8H3 |
| InChIKey | OFMXGFHWLZPCFL-UHFFFAOYSA-N |
| Molecular Weight | 426.729 g/mol |
| SMILES | C12(C(C3CC(C)(C)CCC3(CC2)C)(CCC2(C1CCC1(C(C(=O)CCC21)C)C)C)C)C |
| SPLASH | splash10-002b-9000600000-6ee350580e2600a9675d |
| Source of Spectrum | QA-44-323-1 |
| Synonyms | Friedelin 4,4a,6b,8a,11,11,12b,14a-Octamethylicosahydro-3(2H)-picenone 3(2H)-picenone, eicosahydro-4,4a,6b,8a,11,11,12b,14a-octamethyl-, (4R,4aS,6bR,8aR,12bS,14aS)- 4,4a,6a,6b,8a,11,11,14a-octamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one Friedelan-3-one Friedeline Friedlein EINECS 209-205-1 NSC 55141 |
| Wiley ID | 862447 |