| SpectraBase Compound ID | 2CiHAdeI3y2 |
|---|---|
| InChI | InChI=1S/C30H48O/c1-25(2)15-16-27(5)17-18-29(7)20(21(27)19-25)9-10-23-28(6)13-12-24(31)26(3,4)22(28)11-14-30(23,29)8/h19-20,22-23H,9-18H2,1-8H3/t20-,22?,23-,27-,28+,29-,30-/m1/s1 |
| InChIKey | NQIUPAJMEMKVPU-DCJMUGCMSA-N |
| Mol Weight | 424.7 g/mol |
| Molecular Formula | C30H48O |
| Exact Mass | 424.370516 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | L28W2kODQFx |
|---|---|
| Name | Olean-18-en-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H48O |
| InChI | InChI=1S/C30H48O/c1-25(2)15-16-27(5)17-18-29(7)20(21(27)19-25)9-10-23-28(6)13-12-24(31)26(3,4)22(28)11-14-30(23,29)8/h19-20,22-23H,9-18H2,1-8H3/t20-,22?,23-,27-,28+,29-,30-/m1/s1 |
| InChIKey | NQIUPAJMEMKVPU-DCJMUGCMSA-N |
| Molecular Weight | 424.713 g/mol |
| SMILES | [C@@]12([C@]3([C@](C4=CC(C)(C)CC[C@@]4(CC3)C)([H])CC[C@@]1([C@]1(CCC(C(C1CC2)(C)C)=O)C)[H])C)C |
| SPLASH | splash10-0pdi-0580900000-2cd80691904435416f05 |
| Source of Spectrum | E2-50-1275-3 |
| Wiley ID | 1555894 |