| SpectraBase Compound ID | 2F8pl0bqlvI |
|---|---|
| InChI | InChI=1S/C23H27NO4/c1-13(25)15-12-21-7-8-23(15,27-4)20-22(21)9-10-24(2)17(21)11-14-5-6-16(26-3)19(28-20)18(14)22/h5-8,15,17,20H,9-12H2,1-4H3/t15-,17-,20+,21-,22+,23+/m0/s1 |
| InChIKey | DGSADVAMZWFCMP-MCNQZNANSA-N |
| Mol Weight | 381.47 g/mol |
| Molecular Formula | C23H27NO4 |
| Exact Mass | 381.194008 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6cleWkvpaJY |
|---|---|
| Name | .beta.-Thevinone |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H27NO4 |
| InChI | InChI=1S/C23H27NO4/c1-13(25)15-12-21-7-8-23(15,27-4)20-22(21)9-10-24(2)17(21)11-14-5-6-16(26-3)19(28-20)18(14)22/h5-8,15,17,20H,9-12H2,1-4H3/t15-,17-,20+,21-,22+,23+/m0/s1 |
| InChIKey | DGSADVAMZWFCMP-MCNQZNANSA-N |
| Molecular Weight | 381.472 g/mol |
| SMILES | [C@@]123[C@@]45[C@@](N(CC3)C)(Cc3c1c(c(OC)cc3)O[C@]2([C@]([C@](C(=O)C)(C5)[H])(C=C4)OC)[H])[H] |
| SPLASH | splash10-0a59-0094000000-541e5348646438f8cc3e |
| Source of Spectrum | SK-25-842-2 |
| Wiley ID | 866656 |