![4-Methyl-A-nor-cholestan[3,2-c]isoxazole](/api/spectrum/JtNaRO3PKGg/structure.png?h=300&w=458 "4-Methyl-A-nor-cholestan[3,2-c]isoxazole")
| SpectraBase Compound ID | F66tyyoTp5O |
|---|---|
| InChI | InChI=1S/C29H49NO/c1-18(2)9-8-10-19(3)21-12-13-22-20-11-14-25-27(4,5)26-24(17-31-30-26)29(25,7)23(20)15-16-28(21,22)6/h18-25H,8-17H2,1-7H3/t19-,20+,21-,22+,23+,24?,25?,28-,29+/m1/s1 |
| InChIKey | MATJPXVLKFYYRY-VJKLCDEBSA-N |
| Mol Weight | 427.7 g/mol |
| Molecular Formula | C29H49NO |
| Exact Mass | 427.381415 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JtNaRO3PKGg |
|---|---|
| Name | 4-Methyl-A-nor-cholestan[3,2-c]isoxazole |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H49NO |
| InChI | InChI=1S/C29H49NO/c1-18(2)9-8-10-19(3)21-12-13-22-20-11-14-25-27(4,5)26-24(17-31-30-26)29(25,7)23(20)15-16-28(21,22)6/h18-25H,8-17H2,1-7H3/t19-,20+,21-,22+,23+,24?,25?,28-,29+/m1/s1 |
| InChIKey | MATJPXVLKFYYRY-VJKLCDEBSA-N |
| Molecular Weight | 427.717 g/mol |
| SMILES | [C@@]12(C3C(=NOC3)C(C1CC[C@]1([C@@]3(CC[C@@]([C@]3(CC[C@]21[H])C)([C@@](CCCC(C)C)(C)[H])[H])[H])[H])(C)C)C |
| SPLASH | splash10-0a4m-9100300000-50feeff2a9f6f4641817 |
| Source of Spectrum | KC-1992-432-21 |
| Synonyms | (1R,3aS,3bS,9bR,9cS,11aR)-1-[(1R)-1,5-dimethylhexyl]-6,6,9b,11a-tetramethyl-1,2,3,3a,3b,4,5,5a,6,9,9a,9b,9c,10,11,11a-hexadecahydroindeno[4',5':6,7]indeno[2,1-c]isoxazole 4-Mehyl-A-nor-cholestan[3,2-c]isoxazole |
| Wiley ID | 776125 |