| SpectraBase Compound ID | 8SrnEyQLTbq |
|---|---|
| InChI | InChI=1S/C30H52O2/c1-20(2)22-11-14-25-27(22,4)16-18-29(6)24-13-10-21(3)23(12-15-26(31-8)32-9)28(24,5)17-19-30(25,29)7/h20,22-26H,3,10-19H2,1-2,4-9H3/t22-,23-,24?,25?,27-,28+,29-,30+/m1/s1 |
| InChIKey | OGXOHPJTUYVCOA-BMGVNWFESA-N |
| Mol Weight | 444.7 g/mol |
| Molecular Formula | C30H52O2 |
| Exact Mass | 444.396731 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7WdNdhCAENw |
|---|---|
| Name | 4,23-Binor-3,3-dimethoxy-3,4-secofific-5(24)-ene |
| Alternate Name(s) | 4,23-Bisnor-3,3-dimethoxy-3,4-secofilic-5(24)-ene (4R,5S,8S,9R,13R,17R)-4-(3,3-dimethoxypropyl)-5,8,9,13-tetramethyl-3-methylene-17-propan-2-yl-1,2,4,6,7,10,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene (4R,5S,8S,9R,13R,17R)-4-(3,3-dimethoxypropyl)-5,8,9,13-tetramethyl-3-methylidene-17-propan-2-yl-1,2,4,6,7,10,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H52O2 |
| InChI | InChI=1S/C30H52O2/c1-20(2)22-11-14-25-27(22,4)16-18-29(6)24-13-10-21(3)23(12-15-26(31-8)32-9)28(24,5)17-19-30(25,29)7/h20,22-26H,3,10-19H2,1-2,4-9H3/t22-,23-,24?,25?,27-,28+,29-,30+/m1/s1 |
| InChIKey | OGXOHPJTUYVCOA-BMGVNWFESA-N |
| Molecular Weight | 444.744 g/mol |
| SMILES | [C@]12([C@@](C3CCC([C@]([C@@]3(CC2)C)(CCC(OC)OC)[H])=C)(CC[C@]2(C1CC[C@@]2(C(C)C)[H])C)C)C |
| SPLASH | splash10-0ab9-0190000000-4b7887c53d2cd4852ea3 |
| Source of Spectrum | E1-44-630-2 |
| Wiley ID | 1553310 |