| SpectraBase Compound ID | D5n6PDHKF1K |
|---|---|
| InChI | InChI=1S/C26H44O/c1-17(2)7-6-8-18(3)22-11-12-23-21-10-9-19-15-20(27)16-26(19,5)24(21)13-14-25(22,23)4/h17-19,21-24H,6-16H2,1-5H3/t18-,19+,21+,22?,23+,24+,25-,26+/m1/s1 |
| InChIKey | YPDLLJYJSWXQMO-KTCZKBSDSA-N |
| Mol Weight | 372.6 g/mol |
| Molecular Formula | C26H44O |
| Exact Mass | 372.339216 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8KjuwFiBhDr |
|---|---|
| Name | A-Nor-5-.alpha.-cholestan-2-one |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H44O |
| InChI | InChI=1S/C26H44O/c1-17(2)7-6-8-18(3)22-11-12-23-21-10-9-19-15-20(27)16-26(19,5)24(21)13-14-25(22,23)4/h17-19,21-24H,6-16H2,1-5H3/t18-,19+,21+,22?,23+,24+,25-,26+/m1/s1 |
| InChIKey | YPDLLJYJSWXQMO-KTCZKBSDSA-N |
| Molecular Weight | 372.637 g/mol |
| SMILES | [C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CC(=O)C4)C)[H])[H])(CCC1[C@@](CCCC(C)C)(C)[H])[H])C |
| SPLASH | splash10-01b9-0095000000-a60b3e51c6558a620203 |
| Source of Spectrum | I-69-792-1 |
| Synonyms | (3aS,3bS,5aR,8aS,8bR,10aS)-6-[(1R)-1,5-dimethylhexyl]-3a,5a-dimethyltetradecahydrodicyclopenta[a,f]naphthalen-2(1H)-one (3aS,3bS,5aR,8aS,8bR,10aS)-6-[(1R)-1,5-dimethylhexyl]-3a,5a-dimethyl-3,3b,4,5,6,7,8,8a,8b,9,10,10a-dodecahydro-1H-indeno[5,4-e]inden-2-one (3aS,3bS,5aR,8aS,8bR,10aS)-3a,5a-dimethyl-6-[(2R)-6-methylheptan-2-yl]-3,3b,4,5,6,7,8,8a,8b,9,10,10a-dodecahydro-1H-indeno[5,4-e]inden-2-one |
| Wiley ID | 1355913 |