| SpectraBase Compound ID | 1S4zAG3zyU3 |
|---|---|
| InChI | InChI=1S/C22H28O7/c1-13-8-18(24)22(12-27-14(2)23)17(4-3-6-20(22)11-28-20)21(13)9-16(29-19(21)25)15-5-7-26-10-15/h5,7,10,13,16-18,24H,3-4,6,8-9,11-12H2,1-2H3/t13-,16+,17-,18-,20+,21-,22+/m1/s1 |
| InChIKey | LOZYVHYKXUKJDA-RBANXJOPSA-N |
| Mol Weight | 404.46 g/mol |
| Molecular Formula | C22H28O7 |
| Exact Mass | 404.183503 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IklLpYiz6R7 |
|---|---|
| Name | Truscorodol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H28O7 |
| InChI | InChI=1S/C22H28O7/c1-13-8-18(24)22(12-27-14(2)23)17(4-3-6-20(22)11-28-20)21(13)9-16(29-19(21)25)15-5-7-26-10-15/h5,7,10,13,16-18,24H,3-4,6,8-9,11-12H2,1-2H3/t13-,16+,17-,18-,20+,21-,22+/m1/s1 |
| InChIKey | LOZYVHYKXUKJDA-RBANXJOPSA-N |
| Molecular Weight | 404.459 g/mol |
| SMILES | O[C@]1([C@@]2([C@@]([C@]3(C(O[C@@](C3)(c3cocc3)[H])=O)[C@](C)(C1)[H])(CCC[C@@]21OC1)[H])COC(=O)C)[H] |
| SPLASH | splash10-0007-9000000000-3411400cfbd43e2817c3 |
| Source of Spectrum | CF-9-136-31 |
| Wiley ID | 1556654 |