![2'-Phenyl-5.alpha.-cholest-2-eno[3,2-d]pyrimidine](/api/spectrum/okwclAVoJx/structure.png?h=300&w=458 "2'-Phenyl-5.alpha.-cholest-2-eno[3,2-d]pyrimidine")
| SpectraBase Compound ID | 7uFhymmXop1 |
|---|---|
| InChI | InChI=1S/C35H50N2/c1-23(2)10-9-11-24(3)29-16-17-30-28-15-14-27-20-32-26(21-35(27,5)31(28)18-19-34(29,30)4)22-36-33(37-32)25-12-7-6-8-13-25/h6-8,12-13,22-24,27-31H,9-11,14-21H2,1-5H3/t24-,27+,28+,29-,30+,31+,34-,35+/m1/s1 |
| InChIKey | PWOJBNQOFIDJSJ-HQNAAZPLSA-N |
| Mol Weight | 498.8 g/mol |
| Molecular Formula | C35H50N2 |
| Exact Mass | 498.3974 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | okwclAVoJx |
|---|---|
| Name | 2'-Phenyl-5.alpha.-cholest-2-eno[3,2-d]pyrimidine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C35H50N2 |
| InChI | InChI=1S/C35H50N2/c1-23(2)10-9-11-24(3)29-16-17-30-28-15-14-27-20-32-26(21-35(27,5)31(28)18-19-34(29,30)4)22-36-33(37-32)25-12-7-6-8-13-25/h6-8,12-13,22-24,27-31H,9-11,14-21H2,1-5H3/t24-,27+,28+,29-,30+,31+,34-,35+/m1/s1 |
| InChIKey | PWOJBNQOFIDJSJ-HQNAAZPLSA-N |
| Molecular Weight | 498.799 g/mol |
| SMILES | [C@]12([C@@]3([C@@]([C@]4([C@]([C@]([C@@](CCCC(C)C)(C)[H])([H])CC4)(C)CC3)[H])([H])CC[C@]1(Cc1nc(-c3ccccc3)ncc1C2)[H])[H])C |
| SPLASH | splash10-0008-7000900000-970a48ab0427b19b60cd |
| Source of Spectrum | U-1995-894-5 |
| Wiley ID | 766883 |