| SpectraBase Compound ID | G6tEFHwd8zs |
|---|---|
| InChI | InChI=1S/C29H46O/c1-19-20-10-13-29(7)24(27(20,5)12-11-23(19)30)9-8-21-22-18-25(2,3)14-15-26(22,4)16-17-28(21,29)6/h8,19-20,22,24H,9-18H2,1-7H3/t19-,20-,22-,24+,26+,27-,28+,29+/m0/s1 |
| InChIKey | CPJCHJOEAPXMEU-DKRWJRQQSA-N |
| Mol Weight | 410.7 g/mol |
| Molecular Formula | C29H46O |
| Exact Mass | 410.354866 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FCaZs2Vscsk |
|---|---|
| Name | 24-nor-Olean-12-en-3-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 410.354866100 u |
| Formula | C29H46O |
| InChI | InChI=1S/C29H46O/c1-19-20-10-13-29(7)24(27(20,5)12-11-23(19)30)9-8-21-22-18-25(2,3)14-15-26(22,4)16-17-28(21,29)6/h8,19-20,22,24H,9-18H2,1-7H3/t19-,20-,22-,24+,26+,27-,28+,29+/m0/s1 |
| InChIKey | CPJCHJOEAPXMEU-DKRWJRQQSA-N |
| Molecular Weight | 410.686 g/mol |
| SMILES | [C@]12(C([C@@]3(CC(C)(C)CC[C@@]3(CC2)C)[H])=CC[C@@]2([C@]3(CCC([C@]([C@@]3(CC[C@@]12C)[H])(C)[H])=O)C)[H])C |